SCHEMBL13050813

SCHEMBL13050813

CC(C)(C)N1C(=O)Cc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.51
HPGD P15428 1/20 0.50
KMT2A Q03164 3/20 0.42
CASP3 P42574 2/20 0.42
CASP6 P55212 2/20 0.42
SENP8 Q96LD8 2/20 0.42
SENP7 Q9BQF6 2/20 0.42
SENP6 Q9GZR1 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
OPRM1 P35372 5/20 0.40
OPRK1 P41145 5/20 0.40
OPRL1 P41146 5/20 0.40
MEN1 O00255 2/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
GAA P10253 1/20 0.40
HTR7 P34969 1/20 0.39
RNASEH1 O60930 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Bromide SCHEMBL6853137 0.98 NOTUM (0.50) NOTUMHPGDKMT2ACASP3CASP6
SCHEMBL24119472 0.85 CYP1A2 (0.52) NOTUMHPGDKMT2ACASP3CASP6
SCHEMBL12888750 0.84 DRD2 (0.40) NOTUMHPGDKMT2AOPRM1OPRK1
SCHEMBL12049027 0.83 MEN1 (0.50) NOTUMKMT2ATDP1OPRM1OPRK1
SCHEMBL13965463 0.82 NOTUM (0.46) NOTUMHPGDKMT2ACASP3CASP6
SCHEMBL3923485 0.81 HPGD (0.50) NOTUMHPGDKMT2ACASP3CASP6
SCHEMBL29601091 0.81 HPGD (0.50) NOTUMHPGDKMT2ACASP3CASP6
SCHEMBL24119281 0.79 KMT2A (0.53) NOTUMHPGDKMT2ACASP3CASP6
SCHEMBL14095571 0.79 KMT2A (0.49) NOTUMHPGDKMT2ACASP3CASP6
SCHEMBL22401868 0.78 NOTUM (0.42) NOTUMHPGDKMT2ACASP3CASP6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11753381-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-09-12 US disclosed
US-11753381-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-09-12 US disclosed
US-20220144838-A1 Compounds as Inhibitors of Macrophage Migration Inhibitory Factor Nanjing Immunophage Biotech Co., Ltd. (CN) 2022-05-12 US disclosed
US-20210094921-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2021-04-01 US disclosed
US-9994913-B2 Methods and compositions for detecting and treating drug resistant AKT mutant GENENTECH, INC. (US) 2018-06-12 US disclosed
US-20180009808-A1 CGRP Receptor Antagonists NXERA PHARMA UK LIMITED (GB) 2018-01-11 US disclosed
US-9808457-B2 CGRP receptor antagonists HEPTARES THERAPEUTICS LIMITED (GB) 2017-11-07 US disclosed
US-9802935-B2 CGRP receptor antagonists HEPTARES THERAPEUTICS LIMITED (GB) 2017-10-31 US disclosed
US-20170121348-A1 CGRP Receptor Antagonists NXERA PHARMA UK LIMITED (GB) 2017-05-04 US disclosed
US-20170121331-A1 CGRP Receptor Antagonists NXERA PHARMA UK LIMITED (GB) 2017-05-04 US disclosed
US-20140031259-A1 BIOMARKERS FOR PREDICTING SENSITIVITY TO CANCER TREATMENTS GENENTECH, INC. (US) 2014-01-30 US disclosed
US-8399465-B2 Compounds with two fused bicyclic heteroaryl moieties as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICA NV (BE) 2013-03-19 US disclosed
US-20130059859-A1 PREDICTIVE BIOMARKERS FOR PI3K/AKT KINASE PATHWAY INHIBITOR EFFICACY GENENTECH, INC. (US) 2013-03-07 US disclosed
US-20110081315-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-04-07 US disclosed
US-20100292208-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2010-11-18 US disclosed
US-7473688-B2 Indolobenzazepine HCV NS5B inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-06 US disclosed
US-7319100-B2 Substituted pyrazinones, pyridines and pyrimidines as corticotropin releasing factor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-01-15 US disclosed
US-20070155740-A1 SUBSTITUTED PYRAZINONES, PYRIDINES AND PYRIMIDINES AS CORTICOTROPIN RELEASING FACTOR LIGANDS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-07-05 US disclosed
US-7205306-B2 Substituted pyrazinones, pyridines and pyrimidines as corticotropin releasing factor ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-04-17 US disclosed
US-20070078122-A1 Indolobenzazepine HCV NS5B inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180009808-A1 CGRP Receptor Antagonists CALCRL, CALCR, VIPR1 NOTUM 3684/4885HPGD 767/4885KMT2A 4571/4885
US-20220144838-A1 Compounds as Inhibitors of Macrophage Migration Inhibitory Factor MIF, MMP12, SLC11A2 NOTUM 1843/4885HPGD 734/4885KMT2A 3645/4885
US-20100292208-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE LTA4H, LTC4S, LTB4R NOTUM 759/4885HPGD 217/4885KMT2A 2933/4885
US-11753381-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease RIPK1, RIPK2, RIPK4 NOTUM 3881/4885HPGD 3055/4885KMT2A 3766/4885
US-20070078122-A1 Indolobenzazepine HCV NS5B inhibitors HTR3C, IDO1, HTR3B NOTUM 1778/4885HPGD 3468/4885KMT2A 1730/4885
US-20130059859-A1 PREDICTIVE BIOMARKERS FOR PI3K/AKT KINASE PATHWAY INHIBITOR EFFICACY PIK3R2, PIK3R1, AKT2 NOTUM 4167/4885HPGD 3411/4885KMT2A 2895/4885
US-20070155740-A1 SUBSTITUTED PYRAZINONES, PYRIDINES AND PYRIMIDINES AS CORTICOTROPIN RELEASING FACTOR LIGANDS CRH, CRHR1, CRHR2 NOTUM 4851/4885HPGD 747/4885KMT2A 4301/4885
US-20210094921-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE RIPK1, RIPK2, RIPK4 NOTUM 3881/4885HPGD 3055/4885KMT2A 3766/4885
US-20110081315-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, EIF4A2 NOTUM 4162/4885HPGD 2775/4885KMT2A 2755/4885
US-20170121331-A1 CGRP Receptor Antagonists CALCRL, CALCR, VIPR1 NOTUM 3684/4885HPGD 767/4885KMT2A 4571/4885
US-20170121348-A1 CGRP Receptor Antagonists CALCRL, CALCR, VIPR1 NOTUM 3717/4885HPGD 836/4885KMT2A 4616/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.