SCHEMBL11274647

SCHEMBL11274647

CCOc1ccc(Oc2cccc(C(C(=O)OC)(C(C)C)C(C=C(Cl)Cl)C(C)C)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 2/20 0.36
FPR2 P25090 1/20 0.35
SCN9A Q15858 1/20 0.35
ACACB O00763 5/20 0.35
P2RX3 P56373 4/20 0.33
KAT6A Q92794 2/20 0.33
ACACA Q13085 2/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 2/20 0.32
MAPT P10636 2/20 0.32
PKM P14618 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
KDM4E B2RXH2 2/20 0.32
HTT P42858 1/20 0.32
CCR6 P51684 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11282320 0.91 FPR2 (0.35) ADAMTS4FPR2SCN9AACACBP2RX3
SCHEMBL11275939 0.90 FPR2 (0.35) ADAMTS4FPR2SCN9AACACBP2RX3
SCHEMBL11270557 0.89 P2RX3 (0.38) FPR2SCN9AP2RX3KDM4EL3MBTL1
SCHEMBL11267834 0.89 SCN9A (0.38) FPR2SCN9AP2RX3
SCHEMBL11273179 0.81 FPR2 (0.37) ADAMTS4FPR2SCN9AP2RX3RAB9A
SCHEMBL11282333 0.81 P2RX3 (0.39) FPR2SCN9AP2RX3KDM4ECYP2C9
SCHEMBL11279537 0.81 PPARG (0.34) ADAMTS4FPR2SCN9AP2RX3MAPT
SCHEMBL11279536 0.81 P2RX3 (0.39) FPR2SCN9AP2RX3KDM4EL3MBTL1
SCHEMBL11284587 0.81 P2RX3 (0.40) FPR2SCN9AP2RX3
SCHEMBL11271872 0.80 SCN9A (0.36) FPR2SCN9AP2RX3

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-4338326-A PESTICIDES UNION CARBIDE CORPORATION (US) 1982-07-06 US disclosed