SCHEMBL10730283

SCHEMBL10730283

Fc1ccccc1-c1noc2c(Cl)c(OCCBr)ccc12.Oc1ccc2c(-c3ccccc3F)noc2c1Cl

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 1/20 0.39
▸ PTGS1 P23219 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ PPARA Q07869 10/20 0.32
▸ PPARG P37231 10/20 0.32
▸ PPARD Q03181 10/20 0.32
▸ GPBAR1 Q8TDU6 1/20 0.31
▸ GABRA5 P31644 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ IDO1 P14902 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
SCHEMBL10730831 0.94 FFAR4 (0.39) FFAR4PTGS1PPARAPPARGPPARD
SCHEMBL10735559 0.85 FFAR4 (0.35) FFAR4PTGS1PPARAPPARGPPARD
SCHEMBL10661817 0.85 FFAR4 (0.41) FFAR4PTGS1PPARAPPARGPPARD
SCHEMBL10658344 0.84 PTGS1 (0.42) PTGS1KDM4EGPBAR1NPC1CA12
SCHEMBL10733392 0.83 FFAR4 (0.39) FFAR4PTGS1KDM4EPPARAPPARG
Hydrochloric Acid SCHEMBL10729202 0.82 TP53 (0.39) FFAR4PTGS1KDM4EPPARAPPARG
SCHEMBL10734793 0.82 FFAR4 (0.34) FFAR4PPARAPPARGPPARDNPC1
SCHEMBL10735554 0.81 NPC1 (0.35) PTGS1KDM4EPPARAPPARGPPARD
SCHEMBL10730760 0.81 HTR1A (0.35) FFAR4GABRA5
SCHEMBL10729865 0.81 FFAR4 (0.35) FFAR4GABRA5

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
US-4644064-A DIURETICS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1987-02-17 — — US disclosed
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