SCHEMBL13679607

SCHEMBL13679607

Cc1ccc(NC(=S)Nc2cccnc2)cc1-c1nc2ccccc2[nH]1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.70
▸ KMT2A Q03164 3/20 0.70
▸ NPC1 O15118 3/20 0.70
▸ RAB9A P51151 3/20 0.70
▸ HTT P42858 2/20 0.54
▸ KDM4E B2RXH2 6/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ LDLR P01130 1/20 0.51
▸ HPGD P15428 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MAPT P10636 4/20 0.47
▸ THRB P10828 1/20 0.46
▸ LDHA P00338 1/20 0.45
▸ EPHX2 P34913 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ LMNA P02545 2/20 0.45
▸ GAA P10253 1/20 0.45

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
SCHEMBL13679615 0.88 MEN1 (0.70) MEN1KMT2ANPC1RAB9AHTT
SCHEMBL13679559 0.82 MEN1 (0.78) MEN1KMT2ANPC1RAB9AHTT
SCHEMBL13679713 0.76 TP53 (0.62) MEN1KMT2ANPC1RAB9AHTT
SCHEMBL14642446 0.74 TP53 (0.60) MEN1KMT2AHTTKDM4EALDH1A1
SCHEMBL14642400 0.73 TP53 (0.62) MEN1KMT2AHTTKDM4EALDH1A1
SCHEMBL1336773 0.73 SMO (0.59) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL13679598 0.73 TP53 (0.61) MEN1KMT2ANPC1RAB9AHTT
SCHEMBL13679613 0.73 TP53 (0.64) MEN1KMT2AHTTKDM4EALDH1A1
SCHEMBL13679606 0.72 MAPT (0.66) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL13679620 0.72 LDLR (0.65) NPC1RAB9AKDM4EALDH1A1LDLR

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-1482928-B1 MEDIATORS OF HEDGEHOG SIGNALING PATHWAYS,COMPOSITIONS AND USES RELATED THERETO CURIS INC (US) 2009-09-23 — — EP disclosed
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