SCHEMBL9370651

SCHEMBL9370651

COc1cc2c(cc1CCCC(=O)O)CCCC2

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 1/20 0.58
▸ STING1 Q86WV6 2/20 0.48
▸ FFAR4 Q5NUL3 6/20 0.42
▸ RXRA P19793 2/20 0.40
▸ RXRB P28702 2/20 0.40
▸ RXRG P48443 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ F13A1 P00488 1/20 0.39

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
SCHEMBL24650552 0.82 STING1 (0.43) SLC2A1STING1FFAR4POLBF13A1
SCHEMBL23090401 0.80 HSD17B10 (0.51) SLC2A1RXRARXRBRXRGHTT
SCHEMBL15802564 0.77 RXRG (0.48) FFAR4RXRARXRBRXRGPOLB
SCHEMBL4267107 0.75 STING1 (0.46) STING1HTTNPSR1
SCHEMBL20563708 0.74 TAAR1 (0.58) SLC2A1
SCHEMBL9370660 0.74 RXRA (0.44) FFAR4RXRARXRBRXRG
SCHEMBL27788117 0.74 POLB (0.60) POLB
SCHEMBL11489161 0.74 SLC2A1 (0.51) SLC2A1
SCHEMBL10835634 0.73 PPARA (0.47) FFAR4
SCHEMBL7827237 0.73 NPSR1 (0.55) STING1FFAR4NPSR1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0425946-B1 Iso- and heterocyclic phenylsulphonamides BAYER AG (DE) 1994-08-17 — — EP disclosed
US-5264458-A Antithrombotic iso- and heterocyclic phenylsulphonamides BAYER AKTIENGESELLSCHAFT (DE) 1993-11-23 — — US disclosed
US-5191092-A ANTITHROMBOTIC ISO- AND HETEROCYCLIC PHENYLSULPHONAMIDES BAYER AKTIENGESELLSCHAFT (DE) 1993-03-02 — — US disclosed
EP-0425946-A2 Iso- and heterocyclic phenylsulphonamides BAYER AG (DE) 1991-05-08 — — EP disclosed
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