SCHEMBL4680032

SCHEMBL4680032

C=[Ti](Oc1cccc(-c2ccccc2)c1)C1=C([Si](C)(C)C)C=CC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
EPHX1 P07099 2/20 0.33
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
FAAH O00519 1/20 0.32

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
Hydrochloric Acid SCHEMBL714381 0.99 MAOA (0.33) MAOAMAOBEPHX1CA12CA9
SCHEMBL3232381 0.84 FAAH (0.33) MAOAMAOBFAAH
Hydrochloric Acid SCHEMBL714552 0.83 FAAH (0.32) MAOAMAOBFAAH
Hydrochloric Acid SCHEMBL712588 0.81 EPHX1 (0.33) EPHX1FAAH
SCHEMBL4087717 0.81 CYP3A4 (0.35)
SCHEMBL7931687 0.81 FAAH (0.33) EPHX1FAAH
Hydrochloric Acid SCHEMBL722297 0.80 FAAH (0.33) EPHX1FAAH
Hydrochloric Acid SCHEMBL716605 0.80 RXRA (0.33) EPHX1FAAH
SCHEMBL4684259 0.76 ALDH1A1 (0.31)
SCHEMBL8009952 0.76 MRGPRX4 (0.35) MAOAMAOBEPHX1

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-8247510-B2 Copolymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-21 US disclosed
US-20080234450-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-25 US disclosed
US-20080221287-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-11 US disclosed
US-20080214754-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed
US-20080214756-A1 CYCLIC OLEFIN-DIENE COPOLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed