SCHEMBL2952402

SCHEMBL2952402

N#Cc1ccccc1Nc1c(C(N)=O)sc2c1ccc(=O)n2-c1ccsc1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.33
PDE7A Q13946 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
IKBKB O14920 1/20 0.31
CXCR2 P25025 1/20 0.31
LMNA P02545 2/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
TP53 P04637 1/20 0.30
GAA P10253 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL2954063 0.89 USP2 (0.37) THRBKDM4ESMN1; SMN2CXCR2LMNA
SCHEMBL2949594 0.87 ALDH1A1 (0.39) PDE7AKDM4ELMNAGAAALDH1A1
SCHEMBL2960764 0.86 LMNA (0.38) THRBKDM4ECXCR2LMNAHTT
SCHEMBL2956320 0.83 HPGD (0.34) KDM4EIKBKBCXCR2HTTRAB9A
SCHEMBL4579752 0.82 LMNA (0.32) THRBPDE7ALMNATP53GAA
SCHEMBL2958842 0.81 MAP3K11 (0.36) THRB
SCHEMBL1265882 0.81 USP2 (0.37) THRBKDM4ESMN1; SMN2CXCR2LMNA
Lithium Ion SCHEMBL1265878 0.79 USP2 (0.36) THRBKDM4ESMN1; SMN2CXCR2LMNA
SCHEMBL2957997 0.79 GRM2 (0.37) KDM4ECYP1A2SMN1; SMN2IKBKBCXCR2
SCHEMBL1266311 0.76 MAPT (0.43) THRBKDM4ESMN1; SMN2GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7423047-B2 Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors CELLTECH R&D LIMITED (GB) 2008-09-09 US claimed
US-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors UCB PHARMA S.A. (BE) 2006-01-05 US claimed
US-7763729-B2 Bicyclic heteroaromatic derivatives UCB PHARMA S.A. (BE) 2010-07-27 US disclosed
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives CELLTECH R&D LIMITED (GB) 2009-02-12 US disclosed
US-7423047-B2 Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors CELLTECH R&D LIMITED (GB) 2008-09-09 US disclosed
US-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors UCB PHARMA S.A. (BE) 2006-01-05 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 (2 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-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors MAPK1, CNKSR1, ALK THRB 749/4885PDE7A 1924/4885KDM4E 2174/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 THRB 1114/4885PDE7A 3154/4885KDM4E 2211/4885

“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.