SCHEMBL29907135

SCHEMBL29907135

CCOC(=O)C1CC=C(c2ccc(-c3nn(COCC[Si](C)(C)C)c4cc(OC)c(-c5cccc(C)c5C)nc34)cn2)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 9/20 0.42
TP53 P04637 1/20 0.33
RORC P51449 1/20 0.32
CDK9 P50750 2/20 0.32
CCNT1 O60563 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KLK7 P49862 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL23211110 1.00 DGAT1 (0.42) DGAT1TP53RORCCDK9CCNT1
SCHEMBL23211052 0.87 DGAT1 (0.51) DGAT1TP53MEN1NPC1RAB9A
SCHEMBL29907089 0.87 DGAT1 (0.51) DGAT1TP53MEN1NPC1RAB9A
SCHEMBL29907086 0.81 WNT3A (0.40) DGAT1
SCHEMBL23211063 0.81 WNT3A (0.40) DGAT1
SCHEMBL23210922 0.81 DGAT1 (0.41) DGAT1
SCHEMBL29907079 0.81 DGAT1 (0.41) DGAT1
SCHEMBL23263995 0.80 CDK9 (0.36) TP53CDK9CCNT1ALDH1A1KDM4E
SCHEMBL23210826 0.78 DGAT1 (0.35) DGAT1
SCHEMBL29907003 0.78 DGAT1 (0.35) DGAT1

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-4045151-A1 BICYCLIC HETEROCYCLES AS FGFR INHIBITORS Incyte Corporation (US) 2022-08-24 EP disclosed