SCHEMBL2952207

SCHEMBL2952207

NC(=O)c1sc2c(ccc(=O)n2-c2ccccc2)c1Nc1ccccc1OC(F)F

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.35
HPGD P15428 2/20 0.35
CASP1 P29466 1/20 0.35
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 1/20 0.35
MKNK2 Q9HBH9 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 3/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 2/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL2951770 0.86 C1R (0.37) MAPTPOLB
SCHEMBL2958045 0.83 CXCR2 (0.39) KMT2AHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL2958686 0.82 CXCL8 (0.36) KMT2AHPGDMAPTSMN1; SMN2HTT
SCHEMBL2958873 0.82 MKNK2 (0.35) KMT2AMAPTSMN1; SMN2HTTMKNK2
SCHEMBL2949772 0.80 ALDH1A1 (0.43) KMT2AMAPTSMN1; SMN2HTTALDH1A1
SCHEMBL2958575 0.80 CDK4 (0.38) KMT2AHPGDMAPTSMN1; SMN2HTT
SCHEMBL2954063 0.79 USP2 (0.37) KMT2AHPGDSMN1; SMN2HTTALDH1A1
SCHEMBL3042191 0.77 TOP2A (0.44)
SCHEMBL2956528 0.77 RORC (0.36) KMT2AHPGDMAPTHTTMKNK2
SCHEMBL2960764 0.76 LMNA (0.38) KMT2AHPGDMAPTHTTALDH1A1

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 KMT2A 1316/4885HPGD 3282/4885CASP1 494/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 KMT2A 1383/4885HPGD 3563/4885CASP1 248/4885

“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.