SCHEMBL2948992

SCHEMBL2948992

CCOC(=O)c1sc2[nH]c(=O)ccc2c1Nc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 8/20 0.51
MAPT P10636 4/20 0.51
RAB9A P51151 3/20 0.51
HPGD P15428 3/20 0.51
NPC1 O15118 2/20 0.51
FNTA P49354 1/20 0.49
FNTB P49356 1/20 0.49
ALOX5 P09917 1/20 0.46
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
USP2 O75604 1/20 0.44
NFKB1 P19838 1/20 0.44
MAPK1 P28482 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ILK Q13418 1/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL2956431 0.83 DHODH (0.46) DHODHMAPTFNTAFNTBALDH1A1
SCHEMBL5651378 0.82 ALDH1A1 (0.50) DHODHMAPTRAB9AHPGDNPC1
SCHEMBL1266729 0.78 MAPT (0.46) DHODHMAPTRAB9AHPGDNPC1
SCHEMBL1266606 0.74 MAPT (0.49) DHODHMAPTRAB9AHPGDNPC1
SCHEMBL5648088 0.73 MAPT (0.49) MAPTRAB9AHPGDNPC1ALDH1A1
SCHEMBL2952262 0.73 ALDH1A1 (0.52) DHODHMAPTRAB9AHPGDNPC1
SCHEMBL2957153 0.71 MEN1 (0.46) DHODHMAPTRAB9AHPGDNPC1
SCHEMBL1266627 0.70 MAPT (0.44) DHODHMAPTRAB9AHPGDNPC1
SCHEMBL2958569 0.70 MAPT (0.43) DHODHMAPTRAB9AHPGDNPC1
SCHEMBL6036714 0.70 MEN1 (0.40) DHODHMAPTRAB9AHPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 DHODH 3134/4885MAPT 4305/4885RAB9A 3150/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 DHODH 3227/4885MAPT 4495/4885RAB9A 2791/4885

“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.