SCHEMBL27486013

SCHEMBL27486013

CCCCCCCCCCCCOC(=O)C(C(=O)c1c(Cl)cccc1OC)c1ccccc1.O=P

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.44
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.41
C5 P01031 1/20 0.41

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
SCHEMBL27499363 1.00 PPARA (0.44) PPARANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL27500280 0.99 PPARA (0.42) PPARANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL7175925 0.96 PPARA (0.44) PPARANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL7179851 0.96 PPARA (0.44) PPARANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL7182416 0.96 PPARA (0.44) PPARANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL7188010 0.96 PPARA (0.44) PPARANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL27483922 0.96 ALDH1A1 (0.43) PPARASMN1; SMN2LMNATSHRALDH1A1
SCHEMBL7182618 0.95 PPARA (0.42) PPARANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL27528431 0.92 PPARA (0.48) PPARANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL27528453 0.92 PPARA (0.48) PPARANPC1RAB9ASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1200943-C Organometallic acyl-aryl phosphine CIBA SC HOLDING AG (CH) 2005-05-11 CN disclosed
CN-1308081-A Organometallic acyl-aryl phosphine CIBA SC HOLDING AG (CH) 2001-08-15 CN disclosed