SCHEMBL13679620

SCHEMBL13679620

Cc1ccc(NC(=O)Cc2ccccc2)cc1-c1nc2ccccc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LDLR P01130 3/20 0.65
▸ MAPT P10636 3/20 0.58
▸ LMNA P02545 2/20 0.58
▸ GAA P10253 1/20 0.58
▸ TP53 P04637 2/20 0.58
▸ RXFP1 Q9HBX9 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ MMP2 P08253 4/20 0.54
▸ MMP9 P14780 3/20 0.54
▸ MMP8 P22894 3/20 0.54
▸ MMP13 P45452 3/20 0.54
▸ KDM4E B2RXH2 1/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ THRB P10828 1/20 0.53
▸ KDR P35968 1/20 0.52

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
SCHEMBL14642393 0.87 TP53 (0.72) MAPTLMNAGAATP53RXFP1
SCHEMBL13679606 0.85 MAPT (0.66) LDLRMAPTLMNAGAATP53
SCHEMBL14615285 0.82 MAPT (0.73) MAPTLMNAGAATP53RXFP1
SCHEMBL2244921 0.82 MMP2 (0.78) MAPTLMNATP53ALDH1A1MAPK1
SCHEMBL14615287 0.78 TP53 (0.62) MAPTLMNAGAATP53RXFP1
SCHEMBL13679578 0.78 MAPT (0.73) MAPTLMNAGAATP53RXFP1
SCHEMBL8768635 0.77 MMP2 (0.65) MAPTTP53ALDH1A1MMP2MMP9
SCHEMBL14615294 0.77 MAPT (0.61) MAPTLMNAGAATP53RXFP1
SCHEMBL27202499 0.76 MMP2 (0.68) MAPTALDH1A1HSD17B10MMP2MMP9
SCHEMBL4162041 0.76 KDR (0.56) LMNAGAATP53RXFP1ALDH1A1

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
Send feedback