SCHEMBL7916772

SCHEMBL7916772

N#COc1cccc(CCC[Si](Cl)(Cl)Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 2/20 0.37
MTNR1A P48039 2/20 0.37
MTNR1B P49286 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
RAB9A P51151 1/20 0.34
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33

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
SCHEMBL7906836 0.91 MEN1 (0.38) CHRM2CHRM1CHRM3MTNR1AMTNR1B
SCHEMBL7913932 0.82 CHRM2 (0.44) CHRM2CHRM1CHRM3MTNR1AMTNR1B
SCHEMBL7914886 0.81 CALM1 (0.33)
SCHEMBL7913967 0.80 MTNR1A (0.38) CHRM2CHRM1CHRM3MTNR1AMTNR1B
SCHEMBL7915041 0.76 TAAR1 (0.45) CHRM2CHRM1CHRM3MTNR1AMTNR1B
SCHEMBL158382 0.75 CHRM2 (0.38) CHRM2CHRM1CHRM3MTNR1AMTNR1B
SCHEMBL28114320 0.74 IDO1 (0.41) MEN1KMT2ACYP4F2CYP4A11
SCHEMBL7920249 0.74 ACHE (0.36) CHRM2CHRM1CHRM3MTNR1AMTNR1B
SCHEMBL7914995 0.72 ATM (0.43) KMT2ARAB9A
SCHEMBL5490784 0.72 TAAR1 (0.55) CHRM2MEN1KMT2ATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6217943-B1 ADHESION AND REINFORCEMENT WITH SILANE CYANATE COUPLERS 3M INNOVATIVE PROPERTIES COMPANY 2001-04-17 US disclosed
US-5912377-A CONTAINING AT LEAST ONE CYANATE ESTER GROUP AND HYDROLYZABLE SILYL GROUP; REINFORCED COMPOSITES, ADESIVES, COATINGS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-06-15 US disclosed
EP-0830410-B1 AROMATIC CYANATE ESTER SILANE COUPLING AGENTS MINNESOTA MINING & MFG (US) 1999-04-07 EP disclosed
EP-0830410-A1 AROMATIC CYANATE ESTER SILANE COUPLING AGENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-03-25 EP disclosed
WO-1996039457-A1 AROMATIC CYANATE ESTER SILANE COUPLING AGENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-12-12 WO disclosed