SCHEMBL1047604

SCHEMBL1047604

Nc1ccc(C(=O)NCc2cccnc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.71
ALDH1A1 P00352 4/20 0.71
LMNA P02545 4/20 0.71
HTT P42858 3/20 0.71
MAPT P10636 1/20 0.71
GAA P10253 1/20 0.69
MAPK1 P28482 1/20 0.66
NAMPT P43490 1/20 0.66
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
MMP13 P45452 1/20 0.64
TRPV1 Q8NER1 1/20 0.64
POLB P06746 1/20 0.64
HPGD P15428 1/20 0.64
RECQL P46063 1/20 0.63
NPSR1 Q6W5P4 2/20 0.63
TSHR P16473 1/20 0.63
USP2 O75604 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
TDP1 Q9NUW8 1/20 0.60

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
SCHEMBL28309713 0.88 CA2 (0.71) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL12330697 0.87 CA2 (0.62) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL6569317 0.87 LMNA (0.72) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL5257811 0.87 LMNA (0.72) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL24975530 0.86 HPGDS (0.64) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL29801099 0.86 HPGDS (0.64) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL1161997 0.86 NAMPT (0.75) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL1568226 0.86 ALDH1A1 (0.72) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL5783915 0.85 HTT (0.71) CA2ALDH1A1LMNAHTTMAPT
SCHEMBL2972947 0.85 ALDH1A1 (0.71) CA2ALDH1A1LMNAHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016410-A1 Methods and Compositions Related to Eosinophil Regulation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-01-21 US claimed
WO-2017144393-A1 2-SUBSTITUTED 5-(PHENYL)-1,2-DIHYDRO-3H-3-BENZAZEPINE-3-CARBOXAMIDE DERIVATIVES AS BRD4 INHIBITORS FOR THE TREATMENT OF CANCER BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-08-31 WO disclosed
US-9012419-B2 Methods and compositions related to eosinophil regulation UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-04-21 US disclosed
US-9012419-B2 Methods and compositions related to eosinophil regulation UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-04-21 US disclosed
US-9012419-B2 Methods and compositions related to eosinophil regulation UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-04-21 US disclosed
EP-1928879-B1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL MYERS SQUIBB CO (US) 2013-02-13 EP disclosed
EP-2343303-A1 PI3-kinase inhibitors Boehringer Ingelheim International GmbH (DE) 2011-07-13 EP disclosed
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2009-04-23 US disclosed
WO-2008065198-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 WO disclosed
WO-2008065198-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 WO disclosed
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2008-02-21 US disclosed
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2008-02-21 US disclosed
WO-2007136707-A2 METHODS AND COMPOSITIONS RELATED TO EOSINOPHIL REGULATION UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2007-11-29 WO disclosed
WO-2007136707-A2 METHODS AND COMPOSITIONS RELATED TO EOSINOPHIL REGULATION UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2007-11-29 WO disclosed
WO-2007038314-A2 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-05 WO disclosed
US-20070078136-A1 Fused heterocyclic compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US disclosed
US-20070078136-A1 Fused heterocyclic compounds useful as kinase modulators 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 (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-20070078136-A1 Fused heterocyclic compounds useful as kinase modulators MAP3K2, MAP3K3, MAP4K2 CA2 2509/4885ALDH1A1 3349/4885LMNA 4763/4885
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases COL2A1, MMP1, COL1A1 CA2 3974/4885ALDH1A1 1145/4885LMNA 906/4885
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS MAP3K3, MAP3K2, MAP4K3 CA2 2127/4885ALDH1A1 4291/4885LMNA 4523/4885
US-20100016410-A1 Methods and Compositions Related to Eosinophil Regulation EPX, CCL11, ELANE CA2 2811/4885ALDH1A1 2022/4885LMNA 3114/4885

“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.