SCHEMBL2958686

SCHEMBL2958686

NC(=O)c1sc2c(ccc(=O)n2-c2ccccc2)c1Nc1ccccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 3/20 0.36
CSF1R P07333 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
AKR1B10 O60218 1/20 0.35
UGT1A9 O60656 1/20 0.35
TRPA1 O75762 1/20 0.35
ABCB11 O95342 1/20 0.35
MT-CO2 P00403 1/20 0.35
TTR P02766 1/20 0.35
ALB P02768 1/20 0.35
UGT1A6 P19224 1/20 0.35
UGT1A1 P22309 1/20 0.35
PTGS1 P23219 1/20 0.35
CXCR1 P25024 1/20 0.35
ADRA1A P35348 1/20 0.35
PTGS2 P35354 1/20 0.35
AGTR2 P50052 1/20 0.35
NR1I3 Q14994 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
NR1H4 Q96RI1 1/20 0.35

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
SCHEMBL2956528 0.90 RORC (0.36) CXCL8AKR1B10UGT1A9TRPA1ABCB11
SCHEMBL1267436 0.88 PTGS2 (0.38) CXCL8SMN1; SMN2AKR1B10UGT1A9TRPA1
SCHEMBL2958045 0.88 CXCR2 (0.39) SMN1; SMN2TTRALDH1A1MAPTMEN1
SCHEMBL2958575 0.85 CDK4 (0.38) CSF1RSMN1; SMN2ALDH1A1HTTMAPT
SCHEMBL1266639 0.85 MAPT (0.51) SMN1; SMN2ALDH1A1HTTL3MBTL1MAPT
SCHEMBL2954063 0.84 USP2 (0.37) SMN1; SMN2ALDH1A1HTTMEN1KMT2A
SCHEMBL2958025 0.84 DHODH (0.37) CSF1RALDH1A1MAPTMEN1KMT2A
SCHEMBL2952784 0.82 NPC1 (0.41) CSF1RALDH1A1HTTMAPTMEN1
SCHEMBL2959765 0.82 MAPT (0.42) CSF1RSMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL2951770 0.82 C1R (0.37) MAPT

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 CXCL8 2301/4885CSF1R 412/4885SMN1; SMN2 3637/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 CXCL8 2218/4885CSF1R 328/4885SMN1; SMN2 3472/4885

“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.