SCHEMBL7997930

SCHEMBL7997930

CCCCO[SiH](OCCCl)OCCCC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.38
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
CYP3A4 P08684 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL310148 0.87 ADRB2 (0.45) TSHRALDH1A1ADRB2ADRB1ADRB3
Hydrochloric Acid SCHEMBL9709345 0.84 ADRB2 (0.43) TSHRALDH1A1ADRB2ADRB1ADRB3
Fluoride SCHEMBL27823338 0.84 ADRB2 (0.43) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL16497481 0.81 ADRB2 (0.41) TSHRTDP1ALDH1A1ADRB2ADRB1
SCHEMBL22661054 0.81 ADRB2 (0.41) TSHRTDP1ALDH1A1ADRB2ADRB1
SCHEMBL15414776 0.81 ADRB2 (0.41) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL5345479 0.81 ADRB2 (0.41) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL5410041 0.81 ALDH1A1 (0.37) ALDH1A1
SCHEMBL27849324 0.79 TSHR (0.37) TSHRTDP1ALDH1A1ADRB2ADRB1
SCHEMBL931736 0.79 ADRB2 (0.39) TSHRALDH1A1ADRB2ADRB1ADRB3

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-6277902-B1 RUBBER COMPOUNDS COMPRISING SOLUBLE RUBBER, HYDROPHOBIZED FILLER HAVING SPECIFIED METHANOL WETTABILITY, SUPPORTEDPOLYSULFIDIC-SILANE COMPOUNDS PREPARED BY REACTION OF HALOALKYLSILANES, ORGANIC HALOGEN COMPOUNDS AND POLYSULFIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-08-21 US disclosed
US-5834536-A REACTING HALOGENATED ALKYL SILANE WITH INORGANIC POLYSULFIDE IN PRESENCE OF WATER AND FILLER(CARRIER) FIBERS OR PARTICLES, THEN DRYING BEFORE MIXING INTO RUBBER; FOR HEAT RESISTANT TIRES HAVING LOW ROLLING RESISTANCE BAYER AG (DE) 1998-11-10 US disclosed