SCHEMBL9566280

SCHEMBL9566280

CC(C)(C)[Si](OCC1=C(Cc2ccccc2CCC(=O)O)CCCC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PTGER1 P34995 2/20 0.35
PTGER4 P35408 2/20 0.35
PTGER3 P43115 2/20 0.35
PTGER2 P43116 2/20 0.35
FFAR1 O14842 7/20 0.34
RXRA P19793 2/20 0.33
RXRB P28702 2/20 0.33
RXRG P48443 2/20 0.33
FFAR4 Q5NUL3 4/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
ELANE P08246 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
SCHEMBL9566303 0.85 NPSR1 (0.40) TBXA2RNPSR1PTGER1PTGER4PTGER3
SCHEMBL9566346 0.81 SMYD2 (0.30)
SCHEMBL9566270 0.78 CYP4A11 (0.40) NPSR1PTGER1PTGER4PTGER3PTGER2
SCHEMBL9566258 0.77 SMYD2 (0.32)
SCHEMBL9566211 0.75 FFAR1 (0.40) PTGER1PTGER4PTGER3PTGER2FFAR1
SCHEMBL8701680 0.74 TBXA2R (0.44) TBXA2RNPSR1PTGER1PTGER4PTGER3
SCHEMBL9566301 0.73 AKR1B1 (0.39)
SCHEMBL30159307 0.72 FFAR4 (0.47) FFAR1FFAR4THRATHRB
SCHEMBL305587 0.71 CYP4F2 (0.56)
SCHEMBL9566213 0.71 TBXA2R (0.43) TBXA2RNPSR1PTGER1PTGER4PTGER3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0536713-A1 Oxazole and imidazole derivatives as prostaglandin analogs E.R. SQUIBB & SONS, INC. (US) 1993-04-14 EP disclosed