SCHEMBL9302213

SCHEMBL9302213

O=C(O)N(CCCCl)CCOc1ccc(Oc2cccc(Cl)c2)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 10/20 0.48
▸ PPARD Q03181 8/20 0.48
▸ KDM4E B2RXH2 2/20 0.46
▸ PPARG P37231 9/20 0.43
▸ FFAR1 O14842 3/20 0.43
▸ LPAR1 Q92633 1/20 0.43
▸ LPAR5 Q9H1C0 1/20 0.43
▸ NPC1 O15118 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MRGPRX4 Q96LA9 1/20 0.41
▸ FFAR4 Q5NUL3 1/20 0.40

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
SCHEMBL9165290 0.89 PPARA (0.46) PPARAPPARDKDM4EPPARGFFAR1
SCHEMBL9162214 0.88 NPC1 (0.50) PPARAPPARDKDM4EPPARGFFAR1
SCHEMBL9163304 0.86 PPARA (0.48) PPARAPPARDKDM4EPPARGFFAR1
SCHEMBL9162129 0.86 KDM4E (0.46) PPARAPPARDKDM4EPPARGFFAR1
SCHEMBL9165426 0.85 PPARA (0.48) PPARAPPARDKDM4EPPARGFFAR1
SCHEMBL9163286 0.83 PPARA (0.45) PPARAPPARDKDM4EPPARGFFAR1
SCHEMBL9163492 0.83 KDM4E (0.57) PPARAPPARDKDM4EPPARGFFAR1
SCHEMBL9163552 0.83 PPARA (0.48) PPARAPPARDPPARG
SCHEMBL9158457 0.83 KDM4E (0.42) PPARAPPARDKDM4EPPARGFFAR1
SCHEMBL9165346 0.82 PPARA (0.44) PPARAPPARDKDM4EPPARGFFAR1

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-5346920-A Insecticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-09-13 — — US disclosed
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