SCHEMBL8326378

SCHEMBL8326378

C=CC(=O)OCCC[SiH](C)[O]

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.61
ALDH1A1 P00352 4/20 0.61
CYP3A4 P08684 2/20 0.61
HPGD P15428 1/20 0.60
TP53 P04637 3/20 0.50
HIF1A Q16665 3/20 0.50
HSD17B10 Q99714 1/20 0.50
THRB P10828 2/20 0.42
ATM Q13315 1/20 0.39
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HCAR2 Q8TDS4 3/20 0.35
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HTT P42858 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
SCHEMBL1585542 0.86 TSHR (0.63) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL501946 0.85 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL1741816 0.81 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL7525910 0.81 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL18381172 0.81 TSHR (0.67) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL25262634 0.80 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL21694054 0.80 TSHR (0.65) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL139742 0.79 TSHR (0.59) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL4849695 0.79 TSHR (0.53) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL3338971 0.79 TSHR (0.58) TSHRALDH1A1CYP3A4HPGDTP53

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
US-5914420-A UNSTRAINED POLYMERIZABLE CYCLOSILOXANES HAVING A SUBSTITUENT THAT CONTAINS A PERFLUORINATED ORGANIC MOIETY PCR, INC. (US) 1999-06-22 US disclosed
US-5892086-A Perfluorinated ether organo substituted cyclosiloxanes and copolymers prepared from these cyclosiloxanes PCR, INC. (US) 1999-04-06 US disclosed
US-5494979-A RADIATION CURABLE ACRYLATED SILICON POLYMERS AS RELEASE AGENTS FOR PROTECTIVE BACKINGS OF MATERIALS COATED WITH PRESSURE SENSITIVE ADHESIVES TH. GOLDSCHMIDT AG (DE) 1996-02-27 US disclosed