SCHEMBL11307657

SCHEMBL11307657

O=C(O)C1=CC(C(=O)O)=C(C(=O)O)C1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABAT P80404 1/20 0.31
TSHR P16473 2/20 0.30
GABRR1 P24046 2/20 0.30
SLC6A1 P30531 1/20 0.30
SLC6A13 Q9NSD5 1/20 0.30
GABRP O00591 1/20 0.30
GABRD O14764 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB1 P18505 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 1/20 0.30
GABRB2 P47870 1/20 0.30
GABRA4 P48169 1/20 0.30
GABRE P78334 1/20 0.30
GABRA6 Q16445 1/20 0.30
GABRG1 Q8N1C3 1/20 0.30
GABRG3 Q99928 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
SCHEMBL13830714 0.79 GABRP (0.33) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL30608468 0.65 GSK3A (0.43)
SCHEMBL30608466 0.65 GSK3A (0.43)
SCHEMBL27426329 0.64 TSHR (0.32) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL7568266 0.64
SCHEMBL2296442 0.63
SCHEMBL11430568 0.63 FFAR3 (0.36) TSHR
SCHEMBL13140760 0.62 TSHR (0.39) ABATTSHRGABRR1SLC6A1SLC6A13
SCHEMBL21121534 0.61 NOTUM (0.33) TSHRGABRR1SLC6A1SLC6A13GABRP
SCHEMBL6544012 0.60 GABRP (0.33) TSHRGABRR1GABRPGABRDGABRA1

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-4275184-A HYDROSILATION OF POLYDIMETHYL SILOXANE RHONE-POULENC INDUSTRIES (FR) 1981-06-23 US disclosed
US-4213914-A ADDITION-CONDENSATION COPOLYMERS RHONE-POULENC INDUSTRIES (FR) 1980-07-22 US disclosed
US-4147711-A Ethylenic silicon compounds and thermoplastic elastomers obtained therefrom RHONE-POULENC INDUSTRIES (FR) 1979-04-03 US disclosed
US-4088670-A P-(DIMETHYLVINYLSILYL-METHOXY)-BENZOYL CHLORIDE FROM DIMETHYLVINYL-CHLOROMETHYLSILANE AND A P-HYDROXYBENZOIC ACID RHONE-POULENC INDUSTRIES (FR) 1978-05-09 US disclosed
US-3933745-A Imide copolymers possessing hydroxyl groups RHONE-POULENC S.A. (FR) 1976-01-20 US disclosed