SCHEMBL2913390

SCHEMBL2913390

Cc1cccc(NC(=O)c2cccnc2SCc2ccnc3c(Cl)c(Cl)ccc23)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.45
KDM4E B2RXH2 1/20 0.43
HTT P42858 1/20 0.43
CSF1R P07333 1/20 0.42
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
NPC1 O15118 2/20 0.41
GAA P10253 1/20 0.41
KCNK3 O14649 1/20 0.40
KCNK9 Q9NPC2 1/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
F2R P25116 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
ACLY P53396 1/20 0.39
MAPT P10636 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CASP3 P42574 1/20 0.39

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
SCHEMBL2908904 0.93 KDR (0.46) KDRKDM4EHTTCSF1RKMT2A
SCHEMBL1496333 0.86 KDR (0.46) KDRKDM4EHTTCSF1RKMT2A
SCHEMBL4018128 0.79 KDR (0.58) KDRKDM4EHTTKMT2AMEN1
SCHEMBL1496254 0.78 KDR (0.48) KDRKDM4EHTTKMT2AMEN1
SCHEMBL2914597 0.78 LMNA (0.50) KDRKDM4EHTTKMT2AMEN1
SCHEMBL2916664 0.78 LMNA (0.49) KDRKDM4EHTTKMT2AMEN1
SCHEMBL2909264 0.77 LMNA (0.50) KDRKDM4EHTTKMT2AMEN1
SCHEMBL4019331 0.76 KDR (0.68) KDRKDM4EHTTKMT2AMEN1
SCHEMBL1496284 0.76 KDR (0.52) KDRKMT2AMEN1NPC1GAA
SCHEMBL1496291 0.76 KDM4E (0.47) KDRKDM4EHTTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1854787-B1 NOVEL CYCLIC COMPOUND HAVING QUINOLYLALKYLTHIO GROUP SANTEN PHARMACEUTICAL CO LTD (JP) 2010-09-01 EP claimed