SCHEMBL660837

SCHEMBL660837

COc1ccc2[c]ccnc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.43
ADRA1D P25100 3/20 0.43
ADRA1A P35348 3/20 0.43
ADRA1B P35368 3/20 0.43
KDM4E B2RXH2 3/20 0.42
LMNA P02545 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
NQO2 P16083 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CCR1 P32246 1/20 0.41
CCR5 P51681 1/20 0.41
CCR8 P51685 1/20 0.41
EGFR P00533 2/20 0.41
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40

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
SCHEMBL590041 0.86 LMNA (0.43) HTR1AADRA1DADRA1AADRA1BKDM4E
SCHEMBL9900652 0.78 NPC1 (0.38) LMNARAB9AMEN1NPC1KMT2A
SCHEMBL4471481 0.76 ALDH1A1 (0.46) HTR1AADRA1DADRA1AADRA1BKDM4E
SCHEMBL197798 0.74 PDGFRB (0.46) KDM4EALDH1A1NQO2SMN1; SMN2EGFR
SCHEMBL7435881 0.74 PDGFRB (0.42) HTR1AADRA1DADRA1AADRA1BKDM4E
SCHEMBL217998 0.73 NR4A2 (0.47) MEN1KMT2ACCR1PDGFRBPDGFRA
SCHEMBL29550130 0.72 KDM4E (0.56) HTR1AADRA1DADRA1AADRA1BKDM4E
SCHEMBL622115 0.72 KDM4E (0.56) HTR1AADRA1DADRA1AADRA1BKDM4E
SCHEMBL6048370 0.72 CA1 (0.43) KDM4ELMNARAB9AMEN1NPC1
SCHEMBL855089 0.72 FERMT2 (0.35) KDM4EMEN1ALDH1A1KMT2APDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 US claimed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 US claimed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 EP claimed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 WO claimed
US-20120070413-A1 METHOD OF TREATING CANCER WITH SUBSTITUTED AMIDE DERIVATIVES KIM TAE-SEONG (US) 2012-03-22 US claimed
US-6777543-B2 MACROLIDE COMPOUNDS USEFUL AS ANTIBACTERIAL AND ANTIPROTOZOAL AGENTS IN MAMMALS, INCLUDING MAN, FISH AND BIRDS PFIZER, INC. 2004-08-17 US claimed
US-20030229031-A1 13-Methyl erythromycin derivatives PFIZER INC. 2003-12-11 US claimed
US-20030100518-A1 13-Methyl erythromycin derivatives PFIZER, INC. 2003-05-29 US claimed
US-20030100742-A1 Useful as antibacterial and antiprotozoal agents in mammals, fish and birds; contains a carbamate-containing fused ring PFIZER INC. 2003-05-29 US claimed
EP-1180110-A1 13-METHYL-ERYTHROMYCIN DERIVATIVES Pfizer Products Inc. (US) 2002-02-20 EP claimed
EP-1146051-A2 Erythromycin A derivatives Pfizer Products Inc. (US) 2001-10-17 EP claimed
WO-2000071557-A1 13-METHYL-ERYTHROMYCIN DERIVATIVES PFIZER PRODUCTS INC. (US) 2000-11-30 WO claimed
US-20240101545-A1 SUBSTITUTED NICOTINIMIDE INHIBITORS OF BTK FOR TREATING CANCER GUANGZHOU INNOCARE PHARMA TECH CO LTD (CN) 2024-03-28 US disclosed
US-11840513-B2 Substituted nicotinimide inhibitors of BTK for treating cancer Guangzhou Innocare Pharma Tech Co., Ltd (CN) 2023-12-12 US disclosed
US-11780849-B2 Imino sulfanone inhibitors of ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
CN-115996912-A Iminothiolanone inhibitors of ENPP1 沃拉斯查疗法公司 2023-04-21 CN disclosed
US-20030100518-A1 13-Methyl erythromycin derivatives PFIZER, INC. 2003-05-29 US disclosed
EP-1180110-A1 13-METHYL-ERYTHROMYCIN DERIVATIVES Pfizer Products Inc. (US) 2002-02-20 EP disclosed
EP-1146051-A2 Erythromycin A derivatives Pfizer Products Inc. (US) 2001-10-17 EP disclosed
WO-2000071557-A1 13-METHYL-ERYTHROMYCIN DERIVATIVES PFIZER PRODUCTS INC. (US) 2000-11-30 WO 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 (8 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-11780849-B2 Imino sulfanone inhibitors of ENPP1 ENPP1, ENPP3, SMPD1 HTR1A 2850/4885ADRA1D 3743/4885ADRA1A 4272/4885
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS PIM1, PIM2, PIM3 HTR1A 4053/4885ADRA1D 2576/4885ADRA1A 2915/4885
US-20030100518-A1 13-Methyl erythromycin derivatives RPS4Y1, MRPL21, CYP2F1 HTR1A 765/4885ADRA1D 764/4885ADRA1A 665/4885
US-20240101545-A1 SUBSTITUTED NICOTINIMIDE INHIBITORS OF BTK FOR TREATING CANCER BTK, SYK, LYN HTR1A 4263/4885ADRA1D 4495/4885ADRA1A 4266/4885
US-20120070413-A1 METHOD OF TREATING CANCER WITH SUBSTITUTED AMIDE DERIVATIVES HGF, HGFAC, MET HTR1A 4021/4885ADRA1D 3126/4885ADRA1A 2207/4885
US-20030100742-A1 Useful as antibacterial and antiprotozoal agents in mammals, fish and birds; contains a carbamate-containing fused ring CASP1, CPS1, CASP10 HTR1A 2312/4885ADRA1D 2355/4885ADRA1A 2544/4885
US-20030229031-A1 13-Methyl erythromycin derivatives RPS4Y1, MRPL21, CYP2F1 HTR1A 765/4885ADRA1D 764/4885ADRA1A 665/4885
US-11840513-B2 Substituted nicotinimide inhibitors of BTK for treating cancer BTK, SYK, LYN HTR1A 4263/4885ADRA1D 4495/4885ADRA1A 4266/4885

“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.