SCHEMBL10657879

SCHEMBL10657879

CCC(Oc1c(Cl)c(Cl)c2c(-c3ccccc3F)noc2c1Cl)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.39
▸ GPBAR1 Q8TDU6 1/20 0.36
▸ PPARG P37231 6/20 0.36
▸ PPARA Q07869 6/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ JAK3 P52333 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ PPARD Q03181 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ FABP4 P15090 1/20 0.33

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
SCHEMBL10658293 0.85 PPARA (0.42) MAPTGPBAR1PPARGPPARAPTGS1
SCHEMBL10661841 0.81 MAPT (0.41) MAPTGPBAR1PPARGPPARAPTGS1
SCHEMBL10655898 0.80 KMT2A (0.38) MAPTGPBAR1PTGS1MEN1KMT2A
SCHEMBL10657148 0.78 PTGS1 (0.41) MAPTGPBAR1PTGS1HPGDTSHR
SCHEMBL10661218 0.75 MAPT (0.43) MAPTPPARGPPARAGABRA5PPARD
SCHEMBL10730942 0.74 PTGS1 (0.36) GPBAR1PTGS1HPGDTSHRMAPK1
SCHEMBL10734372 0.74 KMO (0.43) MAPTGPBAR1PPARGPPARAALDH1A1
SCHEMBL10729133 0.73 PTGS1 (0.36) GPBAR1PTGS1HPGDTSHRMAPK1
SCHEMBL10661063 0.72 PTGS1 (0.41) MAPTGPBAR1PTGS1MEN1KMT2A
SCHEMBL11559072 0.72 PTGS1 (0.44) MAPTGPBAR1PTGS1MEN1KMT2A

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