SCHEMBL9925314

SCHEMBL9925314

CNC(C)(C)c1cccc(C(C)(C)NC(=O)c2cc(C(=O)NC(C)(C)c3cccc(C(C)(C)N4C(=O)c5ccc(C(C)=O)cc5C4=O)c3)ccc2C(=O)NCCC[Si](O)(O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ RAB9A P51151 7/20 0.35
▸ NPC1 O15118 4/20 0.35
▸ POLB P06746 3/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ MAPT P10636 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ S100B P04271 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ PDCD1 Q15116 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ ROCK2 O75116 1/20 0.31
▸ ROCK1 Q13464 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ TSHR P16473 1/20 0.31

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
SCHEMBL9925313 0.72 RAB9A (0.45) MEN1KMT2ARAB9APOLBALDH1A1
SCHEMBL9925318 0.68 MEN1 (0.51) MEN1KMT2ARAB9AALDH1A1MAPT
SCHEMBL9925317 0.68 MEN1 (0.36) MEN1KMT2APOLBALDH1A1MAPK1
SCHEMBL4570503 0.67 MEN1 (0.50) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL12227249 0.65 MEN1 (0.47) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL13012944 0.63 RAB9A (0.48) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL12227214 0.59 MEN1 (0.45) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL15942987 0.59 HSD17B10 (0.43) RAB9ANPC1POLBALDH1A1MAPT
SCHEMBL12112145 0.58 S100B (0.83) MEN1KMT2ARAB9APOLBALDH1A1
SCHEMBL4572442 0.56 MEN1 (0.41) MEN1KMT2ARAB9ANPC1POLB

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
US-8802766-B2 Silane-containing polyamideimide intermediate transfer members XEROX CORPORATION (US) 2014-08-12 — — US disclosed
US-20120148316-A1 SILANE-CONTAINING POLYAMIDEIMIDE INTERMEDIATE TRANSFER MEMBERS XEROX CORPORATION (US) 2012-06-14 — — US disclosed
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