SCHEMBL8977329

SCHEMBL8977329

CCC[C@H]1CC[C@H]([SiH]2CCC(CCc3ccc(F)cc3)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.44
MAOA P21397 1/20 0.38
TAAR1 Q96RJ0 2/20 0.33
KCNH2 Q12809 1/20 0.33
HRH3 Q9Y5N1 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
SCHEMBL8432737 1.00 MAOB (0.44) MAOBMAOATAAR1KCNH2HRH3
SCHEMBL8432734 1.00 MAOB (0.44) MAOBMAOATAAR1KCNH2HRH3
SCHEMBL8432742 0.92 MAOB (0.42) MAOBMAOAHRH3
SCHEMBL8432739 0.92 MAOB (0.42) MAOBMAOAHRH3
SCHEMBL8434869 0.91 MAOB (0.41) MAOBMAOA
SCHEMBL8977228 0.91 MAOB (0.41) MAOBMAOA
SCHEMBL8434853 0.91 MAOB (0.41) MAOBMAOA
SCHEMBL8434854 0.91 MAOB (0.41) MAOBMAOA
SCHEMBL8434871 0.91 MAOB (0.41) MAOBMAOA
SCHEMBL10479720 0.86 MAOB (0.51) MAOBMAOATAAR1

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-5523439-A Process for preparing silacyclohexane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-06-04 US disclosed
EP-0696592-A1 Process for preparing silacyclohexane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-02-14 EP disclosed