SCHEMBL4901407

SCHEMBL4901407

CC(C)(C)NC(=O)C1CCCCN1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
PRCP P42785 3/20 0.44
DPP7 Q9UHL4 2/20 0.39
HTR2C P28335 2/20 0.38
HTR2B P41595 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
ULK1 O75385 1/20 0.37
HDAC2 Q92769 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CTSC P53634 2/20 0.35
CTSK P43235 1/20 0.35
KCNH2 Q12809 1/20 0.35
DPP4 P27487 2/20 0.35
SSTR4 P31391 1/20 0.35
FAP Q12884 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35

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
SCHEMBL7268303 1.00 L3MBTL1 (0.57) L3MBTL1PRCPDPP7HTR2CHTR2B
SCHEMBL17676963 0.94 L3MBTL1 (0.54) L3MBTL1PRCPDPP7HTR2CHTR2B
SCHEMBL1983142 0.94 L3MBTL1 (0.54) L3MBTL1PRCPDPP7HTR2CHTR2B
SCHEMBL495672 0.94 L3MBTL1 (0.54) L3MBTL1PRCPDPP7HTR2CHTR2B
Hydrochloric Acid SCHEMBL6860843 0.93 L3MBTL1 (0.53) L3MBTL1PRCPDPP7HTR2CHTR2B
SCHEMBL15373851 0.88 L3MBTL1 (0.54) L3MBTL1PRCPDPP7TSHRALDH1A1
SCHEMBL26501818 0.88 L3MBTL1 (0.54) L3MBTL1PRCPDPP7TSHRALDH1A1
SCHEMBL27284993 0.79 PRCP (0.45) L3MBTL1PRCPDPP7HTR2CHTR2B
SCHEMBL13306379 0.79 PRCP (0.47) L3MBTL1PRCPDPP7HTR2CHTR2B
SCHEMBL22221409 0.79 PRCP (0.47) L3MBTL1PRCPDPP7HTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1062536-A Retroviral protease inhibitors from 3-chloro-2-chloromethyl-1-propylene derived AMERICAN CYANAMID CO (US) 1992-07-08 CN claimed
EP-0492136-A2 Retroviral protease inhibitors derived from 3-chloro-2-chloromethyl-1-propene AMERICAN CYANAMID COMPANY (US) 1992-07-01 EP claimed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-8293757-B2 5-(4-(haloalkoxy)phenyl) pyrimidine-2-amine compounds and compositions as kinase inhibitors IRM LLC (BM) 2012-10-23 US disclosed
US-8288540-B2 2-heteroarylamino-pyrimidine derivatives as kinase inhibitors IRM LLC (BM) 2012-10-16 US disclosed
US-8288540-B2 2-heteroarylamino-pyrimidine derivatives as kinase inhibitors IRM LLC (BM) 2012-10-16 US disclosed
US-20110263539-A1 SHIP 1 MODULATOR COMPOUNDS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2011-10-27 US disclosed
US-20110053952-A1 2-HETEROARYLAMINO-PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2011-03-03 US disclosed
US-20110053952-A1 2-HETEROARYLAMINO-PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2011-03-03 US disclosed
US-20100323990-A1 SHIP 1 MODULATOR PRODRUGS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2010-12-23 US disclosed
US-20100323990-A1 SHIP 1 MODULATOR PRODRUGS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2010-12-23 US disclosed
US-7026485-B2 Retroviral protease inhibitors G.D. SEARLE & CO. (US) 2006-04-11 US disclosed
US-20050004230-A1 Retroviral protease inhibitors MONSANTO COMPANY (NOW NAMED PHARMACIA CORPORATION, WHICH IS A WHOLLY OWNED SUBSIDIARY OF PFIZER, INC (US) 2005-01-06 US disclosed
US-6762187-B2 HETEROCYCLIC NITROGEN COMPOUNDS USED AS ENZYME INHIBITORS FOR PROPHYLAXIS OF HUMAN IMMUNODEFICIENCY VIRUS(HIV) MONSANTO COMPANY 2004-07-13 US disclosed
US-6506759-B1 Method for treating HIV-related AIDS comprising administering an effective amount of a composition N-heterocyclic moiety containing hydroxyethylamine compounds are effective as retroviral protease inhibitors, and in MONSANTO COMPANY 2003-01-14 US disclosed
US-6180646-B1 PREVENT REPRODUCTION OF RETROVIRUS MONSANTO COMPANY 2001-01-30 US disclosed
US-6127372-A FOR TREATMENT OR PREVENTION OF VIRAL DISEASES, ESPECIALLY AIDS OR HIV VERTEX PHARMACEUTICALS, INCORPORATED (US) 2000-10-03 US disclosed
EP-0749421-B1 SULPHONAMIDE DERIVATIVES AS ASPARTYL PROTEASE INHIBITORS VERTEX PHARMA (US) 1999-09-15 EP disclosed
WO-1995024385-A1 SULPHONAMIDE DERIVATIVES AS ASPARTYL PROTEASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 1995-09-14 WO disclosed
CN-1062536-A Retroviral protease inhibitors from 3-chloro-2-chloromethyl-1-propylene derived AMERICAN CYANAMID CO (US) 1992-07-08 CN 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 (4 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-20100323990-A1 SHIP 1 MODULATOR PRODRUGS PPM1D, PPM1G, PPM1F L3MBTL1 1588/4885PRCP 2198/4885DPP7 3064/4885
US-20110263539-A1 SHIP 1 MODULATOR COMPOUNDS PPM1F, PPM1D, PPP1R1B L3MBTL1 2124/4885PRCP 2254/4885DPP7 2662/4885
US-20050004230-A1 Retroviral protease inhibitors MME, PREP, TMPRSS15 L3MBTL1 798/4885PRCP 37/4885DPP7 92/4885
US-20110053952-A1 2-HETEROARYLAMINO-PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS FYN, LCK, ERBB2 L3MBTL1 3713/4885PRCP 3643/4885DPP7 2268/4885

“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.