SCHEMBL5579052

SCHEMBL5579052

CCNc1ccccc1-c1ccc(F)cc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 3/20 0.43
PKM P14618 1/20 0.42
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
IDO1 P14902 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
CASP1 P29466 1/20 0.36
BRCA1 P38398 1/20 0.36
CASP7 P55210 1/20 0.36
GPR3 P46089 1/20 0.36
RECQL P46063 2/20 0.35
ALDH1A1 P00352 1/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPK14 Q16539 1/20 0.35
PTGES2 Q9H7Z7 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
SCHEMBL5214473 0.87 SMN1; SMN2 (0.39) CHRM3PKMMAPTSMN1; SMN2IDO1
SCHEMBL3903024 0.84 PSIP1 (0.43) CHRM3MAPTSMN1; SMN2IDO1MEN1
SCHEMBL5579139 0.84 HSD11B1 (0.40) CHRM3MAPTSMN1; SMN2IDO1MEN1
SCHEMBL1168220 0.80 IDO1 (0.52) PKMMAPTSMN1; SMN2IDO1MEN1
SCHEMBL3904434 0.77 QPCT (0.49) CHRM3MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3906106 0.77 QPCT (0.52) CHRM3MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL26075333 0.76 DHODH (0.41) MEN1KMT2A
SCHEMBL1116575 0.76 PKM (0.47) PKMMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL20989248 0.73 NFE2L2 (0.48) GPR3ALDH1A1NPC1MAPK14
SCHEMBL23590338 0.73 DHODH (0.58) MEN1KMT2AALDH1A1NPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784391-A1 PHENANTHRIDINE CARBONYL PHENOLS AS CYTOKINE EXPRESSION MODULATORS Wyeth (US) 2007-05-16 EP disclosed
WO-2006028875-A1 PHENANTHRIDINE CARBONYL PHENOLS AS CYTOKINE MODULATORS WYETH (US) 2006-03-16 WO disclosed