SCHEMBL2804700

SCHEMBL2804700

O=C(Nc1ccc2c(c1)CCNC2)c1ccccc1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
ATM Q13315 1/20 0.58
TP53 P04637 1/20 0.55
CHRNB2 P17787 1/20 0.55
CHRNB4 P30926 1/20 0.55
CHRNA3 P32297 1/20 0.55
CHRNA4 P43681 1/20 0.55
APOB P04114 1/20 0.53
MTTP P55157 1/20 0.53
HTT P42858 2/20 0.52
ALDH1A1 P00352 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 1/20 0.52
CYP2C9 P11712 1/20 0.52
TSHR P16473 1/20 0.52
F2 P00734 1/20 0.52
PLG P00747 1/20 0.52
PLAU P00749 1/20 0.52
PLAT P00750 1/20 0.52

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
SCHEMBL8208303 0.88 APOB (0.62) MEN1KMT2AATMAPOBMTTP
SCHEMBL8197860 0.82 MELK (0.68) TP53HTTF2PLGPLAU
SCHEMBL5534830 0.81 MELK (0.47) MEN1KMT2AATMF2PLG
SCHEMBL6643542 0.80 F2 (0.51) MEN1KMT2AATMTP53HTT
SCHEMBL11735609 0.79 RAB9A (0.58) MEN1KMT2AHTTALDH1A1F2
SCHEMBL6717205 0.78 NPC1 (0.70) MEN1KMT2ATP53HTTLMNA
SCHEMBL3658561 0.78 F2 (0.57) F2PLGPLAUPLATKLKB1
SCHEMBL3704728 0.77 CD274 (0.55) MEN1KMT2AATMUSP28
SCHEMBL29431209 0.77 MELK (0.76) TP53HTTF2PLGPLAU
SCHEMBL4566270 0.77 MELK (0.76) TP53HTTF2PLGPLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569282-B2 Carboxamide compounds and their use CYTOPATHFINDER, INC. (JP) 2013-10-29 US disclosed
US-20100331298-A1 Carboxamide Compounds and Their Use CYTOPATHFINDER, INC. (JP) 2010-12-30 US disclosed
US-20100324035-A1 Carboxamide Compounds and Their Use CYTOPATHFINDER, INC. (JP) 2010-12-23 US disclosed
EP-1651232-B1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP (US) 2010-12-22 EP disclosed
CN-101925383-A Carboxamide compounds and their use as chemokine receptor agonists EPIX DELAWARE INC 2010-12-22 CN disclosed
US-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE EPIX DELAWARE, INC. (US) 2010-08-19 US disclosed
US-20100184749-A1 BENZOTHIADIAZINE COMPOUNDS AND THEIR USE EPIX Delaware ,Inc. (US) 2010-07-22 US disclosed
EP-1268404-B1 MALONAMIC ACIDS AND DERIVATIVES THEREOF AS THYROID RECEPTOR LIGANDS PFIZER PROD INC (US) 2008-01-02 EP disclosed
US-20070173548-A1 Malonamic acids and derivatives thereof as thyroid receptor ligands CHIANG YUAN-CHING P 2007-07-26 US disclosed
US-7202275-B2 Malonamic acids and derivatives thereof as thyroid receptor ligands WARNER LAMBERT COMPANY LLC (US) 2007-04-10 US disclosed
US-20010046956-A1 Methods of treating obesity using a neurotensin receptor ligand HADCOCK JOHN R (US) 2001-11-29 US disclosed
EP-1157695-A1 Method of treating obesity using a neurotensin receptor ligand Pfizer Products Inc. (US) 2001-11-28 EP disclosed
EP-1148054-A1 Thyroid receptor ligands Pfizer Products Inc. (US) 2001-10-24 EP disclosed
WO-2001072692-A1 MALONAMIC ACIDS AND DERIVATIVES THEREOF AS THYROID RECEPTOR LIGANDS PFIZER PRODUCTS INC. (US) 2001-10-04 WO disclosed
EP-1127882-A1 Tetrazole compounds as thyroid receptor ligands Pfizer Products Inc. (US) 2001-08-29 EP disclosed
EP-1125579-A2 Uses of agrp-melanocortin receptor binding modulating compounds Pfizer Products Inc. (US) 2001-08-22 EP disclosed
US-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
EP-1099701-A1 7-[(4'-Trifluoromethyl-biphenyl-2-carbonyl)amino]-quinoline-3-carboxylic acid amides, and methods of inhibiting the secretion of apolipoprotein B Pfizer Products Inc. (US) 2001-05-16 EP disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed
US-5919795-A ATHEROSCLEROSIS THERAPY PFIZER INC. (US) 1999-07-06 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 (5 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-20100331298-A1 Carboxamide Compounds and Their Use CCR2, CCR1, CCR5 MEN1 4753/4885KMT2A 2026/4885ATM 3711/4885
US-20100210633-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE CCR2, CCR1, CCR5 MEN1 4753/4885KMT2A 2026/4885ATM 3711/4885
US-20100184749-A1 BENZOTHIADIAZINE COMPOUNDS AND THEIR USE CCR2, CCR5, CCR1 MEN1 4863/4885KMT2A 4028/4885ATM 3016/4885
US-20070173548-A1 Malonamic acids and derivatives thereof as thyroid receptor ligands THRA, MC1R, TSHR MEN1 384/4885KMT2A 3859/4885ATM 1796/4885
US-20100324035-A1 Carboxamide Compounds and Their Use CCR2, CCR1, CCR5 MEN1 4772/4885KMT2A 2106/4885ATM 3464/4885

“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.