SCHEMBL10240596

SCHEMBL10240596

CC(C)C(=O)C(N)Cc1c[nH]c2ccccc12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.74
MAPT P10636 2/20 0.74
MEN1 O00255 1/20 0.74
LMNA P02545 1/20 0.74
MPO P05164 1/20 0.74
TSHR P16473 1/20 0.74
BLM P54132 1/20 0.74
PMP22 Q01453 1/20 0.74
KMT2A Q03164 1/20 0.74
HIF1A Q16665 1/20 0.74
HTR2A P28223 2/20 0.72
ADRB1 P08588 1/20 0.72
HTR1A P08908 1/20 0.72
ADRA2A P08913 1/20 0.72
SLC6A2 P23975 1/20 0.72
HTR1D P28221 1/20 0.72
HTR1B P28222 1/20 0.72
HTR2C P28335 1/20 0.72
HTR1E P28566 1/20 0.72
SLC6A4 P31645 1/20 0.72

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
SCHEMBL681059 1.00 KDM4E (0.74) KDM4EMAPTMEN1LMNAMPO
SCHEMBL13659773 1.00 KDM4E (0.74) KDM4EMAPTMEN1LMNAMPO
SCHEMBL14136165 0.93 KDM4E (0.72) KDM4EMAPTMEN1LMNAMPO
SCHEMBL25562536 0.89 KDM4E (0.67) KDM4EMAPTMEN1LMNAMPO
SCHEMBL27280675 0.89 KDM4E (0.67) KDM4EMAPTMEN1LMNAMPO
SCHEMBL10030545 0.87 KDM4E (0.76) KDM4EMAPTMEN1LMNAMPO
SCHEMBL13662877 0.87 KDM4E (0.76) KDM4EMAPTMEN1LMNAMPO
SCHEMBL12104024 0.87 KDM4E (0.76) KDM4EMAPTMEN1LMNAMPO
SCHEMBL23762398 0.86 HTR2A (0.60) KDM4EMAPTMEN1LMNAMPO
SCHEMBL3158262 0.86 KDM4E (0.70) KDM4EMAPTMEN1LMNAMPO

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230322743-A1 NOVEL SAFRYLAMINE DERIVATIVES HAVING PRODRUG PROPERTIES MIHKAL GMBH (CH) 2023-10-12 US disclosed
US-20230322743-A1 NOVEL SAFRYLAMINE DERIVATIVES HAVING PRODRUG PROPERTIES MIHKAL GMBH (CH) 2023-10-12 US disclosed
US-9738660-B2 Selective inhibitors for protein kinases and pharmaceutical composition and use thereof NATIONAL CHIAO TUNG UNIVERSITY (CN) 2017-08-22 US disclosed
US-9738660-B2 Selective inhibitors for protein kinases and pharmaceutical composition and use thereof NATIONAL CHIAO TUNG UNIVERSITY (CN) 2017-08-22 US disclosed
US-20160096848-A1 SELECTIVE INHIBITORS FOR PROTEIN KINASES AND PHARMACEUTICAL COMPOSITION AND USE THEREOF NATIONAL CHIAO TUNG UNIVERSITY (CN) 2016-04-07 US disclosed
US-RE44186-E1 Cyclopropyl-fused pyrrolidine-based inhibitors of dipeptidyl peptidase IV and method BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-30 US disclosed
US-8119654-B2 Indenoisoquinolinone analogs and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION (US) 2012-02-21 US disclosed
US-20100179140-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2010-07-15 US disclosed
US-20100121049-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2010-05-13 US disclosed
US-20100121049-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2010-05-13 US disclosed
US-7652028-B2 Indenoisoquinolinone analogs and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION (US) 2010-01-26 US disclosed
US-20100004220-A1 Indenoisoquinolinone Analogs and Methods of Use Thereof INOTEK PHARMACEUTICALS CORPORATION 2010-01-07 US disclosed
WO-2008106619-A2 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2008-09-04 WO disclosed
US-20070049555-A1 Indenoisoquinolinone analogs and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION (US) 2007-03-01 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 (6 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-20070049555-A1 Indenoisoquinolinone analogs and methods of use thereof TNNI3, IDH2, GLS KDM4E 2660/4885MAPT 1116/4885MEN1 4008/4885
US-20160096848-A1 SELECTIVE INHIBITORS FOR PROTEIN KINASES AND PHARMACEUTICAL COMPOSITION AND USE THEREOF CSNK1A1, MAP3K1, PACSIN2 KDM4E 1949/4885MAPT 2180/4885MEN1 2477/4885
US-20230322743-A1 NOVEL SAFRYLAMINE DERIVATIVES HAVING PRODRUG PROPERTIES HTR2A, HTR2C, HTR1D KDM4E 3572/4885MAPT 2363/4885MEN1 3766/4885
US-20100121049-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF TNNI3, IDH2, GLS KDM4E 2660/4885MAPT 1116/4885MEN1 4008/4885
US-20100004220-A1 Indenoisoquinolinone Analogs and Methods of Use Thereof TNNI3, IDH2, GLS KDM4E 2660/4885MAPT 1116/4885MEN1 4008/4885
US-20100179140-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF TNNI3, IDH2, GLS KDM4E 2660/4885MAPT 1116/4885MEN1 4008/4885

“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.