SCHEMBL9304370

SCHEMBL9304370

COC(CCCCCCCCCCCCCNCCCCN)[SiH](C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.43
F13A1 P00488 2/20 0.43
CA2 P00918 2/20 0.43
CYP1A2 P05177 2/20 0.43
ALOX15 P16050 2/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
CA5A P35218 2/20 0.43
THPO P40225 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
CA5B Q9Y2D0 2/20 0.43
CA1 P00915 1/20 0.43
CA3 P07451 1/20 0.43
CYP2C9 P11712 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
MTOR P42345 1/20 0.43
LMNA P02545 1/20 0.42

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
SCHEMBL3793379 0.71 ZDHHC7 (0.38) TSHRLMNA
SCHEMBL18691358 0.71 ZDHHC7 (0.38) TSHRLMNA
SCHEMBL18691419 0.71 ZDHHC7 (0.38) TSHRLMNA
SCHEMBL11794534 0.71 CA12 (0.56) CA12F13A1CA2CYP1A2ALOX15
SCHEMBL3222075 0.71 ZDHHC7 (0.38) TSHRLMNA
SCHEMBL4415101 0.71 CA12 (0.56) CA12F13A1CA2CYP1A2ALOX15
SCHEMBL28521171 0.70 CA12 (0.54) CA12F13A1CA2CYP1A2ALOX15
SCHEMBL21131128 0.70 CA12 (0.54) CA12F13A1CA2CYP1A2ALOX15
SCHEMBL21131221 0.70 CA12 (0.54) CA12F13A1CA2CYP1A2ALOX15
SCHEMBL25725601 0.70 CA12 (0.54) CA12F13A1CA2CYP1A2ALOX15

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-5329039-A Bromoalkyl trimethoxy silane, surface treatment of silica filler, improved water resistance of molding resins SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-07-12 US disclosed
EP-0484123-A1 Alkoxysilane compounds and their use as coupling agents SHIN-ETSU CHEMICAL CO., LTD. (JP) 1992-05-06 EP disclosed