SCHEMBL3815419

SCHEMBL3815419

NCCC[SiH2]C(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.41
HTR2A P28223 1/20 0.39
HRH1 P35367 1/20 0.39
SLC7A5 Q01650 7/20 0.38
MAOA P21397 1/20 0.36
LTA4H P09960 1/20 0.36
PLA2G2A P14555 1/20 0.36
KCNA3 P22001 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
SCHEMBL705385 0.90 KCNA3 (0.39) TAAR1LTA4HKCNA3
SCHEMBL704372 0.90 KCNA3 (0.39) TAAR1LTA4HKCNA3
SCHEMBL705838 0.86 LTA4H (0.38) TAAR1LTA4HKCNA3
SCHEMBL4363261 0.83 KCNA3 (0.34) LTA4HKCNA3
SCHEMBL4361027 0.83 KCNA3 (0.39) TAAR1HTR2AHRH1LTA4HKCNA3
SCHEMBL704602 0.77 LTA4H (0.38) TAAR1LTA4HKCNA3
SCHEMBL4354696 0.74 LTA4H (0.35) LTA4HKCNA3
SCHEMBL4363429 0.74 KCNA3 (0.39) TAAR1MAOALTA4HKCNA3
SCHEMBL30309249 0.72 HRH1 (0.52) TAAR1HTR2AHRH1SLC7A5MAOA
SCHEMBL27842300 0.69 HRH1 (0.54) TAAR1HTR2AHRH1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1086969-B1 NOVEL POLYISOCYANATE AND METHOD FOR PRODUCING THE SAME ASAHI CHEMICAL IND (JP) 2009-08-12 EP disclosed
US-6469122-B1 POLYISOCYANATE OBTAINED BY REACTING A DIISOCYANATE SELECTED FROM AN ALIPHATIC DIISOCYANATE AND AN ALICYCLIC DIISOCYANATE WITH A POLYOL HAVING A NUMBER AVERAGE MOLECULAR WEIGHT OF FROM 3,000 TO 30,000; CURABLE SEALANT ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-10-22 US disclosed
EP-1086969-A1 NOVEL POLYISOCYANATE AND PROCESS FOR PRODUCING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2001-03-28 EP disclosed