SCHEMBL10659368

SCHEMBL10659368

CCC(C)(Oc1ccc2c(-c3ccccc3F)noc2c1Cl)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 12/20 0.40
▸ PPARG P37231 10/20 0.40
▸ PPARD Q03181 9/20 0.40
▸ GPBAR1 Q8TDU6 1/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ CTSA P10619 2/20 0.35
▸ GABRA5 P31644 2/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.34
▸ TP53 P04637 1/20 0.34

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
SCHEMBL10663477 0.92 PPARA (0.40) PPARAPPARGPPARDGPBAR1PTGS1
SCHEMBL10663114 0.88 PPARA (0.44) PPARAPPARGPPARDGPBAR1PTGS1
SCHEMBL10656221 0.83 PPARA (0.40) PPARAPPARGPPARDGPBAR1PTGS1
SCHEMBL4035353 0.79 FFAR4 (0.44) PPARAPPARGPPARDGPBAR1PTGS1
SCHEMBL10661841 0.79 MAPT (0.41) PPARAPPARGPPARDGPBAR1PTGS1
SCHEMBL10738125 0.77 PPARG (0.44) PPARAPPARGPPARDGPBAR1PTGS1
SCHEMBL10663076 0.77 SLC22A12 (0.43) GPBAR1PTGS1
SCHEMBL10662256 0.77 ALDH1A1 (0.44) GPBAR1PTGS1FFAR4
SCHEMBL10657284 0.77 FFAR4 (0.40) PPARAPPARGPPARDGPBAR1PTGS1
SCHEMBL10732274 0.77 GPBAR1 (0.42) GPBAR1PTGS1CTSAGABRA5FFAR4

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-4673746-A DIURETICS, HYPOTENSIVES HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1987-06-16 — — US claimed
US-4728662-A DIURETICS, URICOSURICS, HYPOTENSIVES HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-03-01 — — US disclosed
US-4673746-A DIURETICS, HYPOTENSIVES HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1987-06-16 — — US disclosed
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