SCHEMBL9514995

SCHEMBL9514995

CC(C=CC1CC1c1ccc(Br)c(Br)c1)=CC(=O)NCC(C)C

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CETP P11597 1/20 0.40
RXRA P19793 4/20 0.34
RARB P10826 2/20 0.34
RARG P13631 2/20 0.34
TRPV1 Q8NER1 2/20 0.32
HPGD P15428 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CNR2 P34972 1/20 0.31
EPHX2 P34913 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL9514986 1.00 CETP (0.40) CETPRXRARARBRARGTRPV1
SCHEMBL9567125 1.00 CETP (0.40) CETPRXRARARBRARGTRPV1
SCHEMBL9430474 1.00 CETP (0.40) CETPRXRARARBRARGTRPV1
SCHEMBL9431554 1.00 CETP (0.40) CETPRXRARARBRARGTRPV1
SCHEMBL9516760 1.00 CETP (0.40) CETPRXRARARBRARGTRPV1
SCHEMBL9518904 0.92 CETP (0.36) CETPRXRARARBRARGTRPV1
SCHEMBL9518906 0.92 CETP (0.36) CETPRXRARARBRARGTRPV1
SCHEMBL9516919 0.92 CETP (0.36) CETPRXRARARBRARGTRPV1
SCHEMBL9516914 0.92 CETP (0.36) CETPRXRARARBRARGTRPV1
SCHEMBL9519022 0.92 CETP (0.36) CETPRXRARARBRARGTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0369762-B1 Pesticides ROUSSEL UCLAF (FR) 1993-12-29 EP claimed
US-5202356-A Insecticides, miticides THE WELLCOME FOUNDATION LIMITED (GB) 1993-04-13 US claimed
EP-0369762-A1 Pesticides ROUSSEL-UCLAF (FR) 1990-05-23 EP claimed
EP-0369762-B1 Pesticides ROUSSEL UCLAF (FR) 1993-12-29 EP disclosed
US-5202356-A Insecticides, miticides THE WELLCOME FOUNDATION LIMITED (GB) 1993-04-13 US disclosed
EP-0369762-A1 Pesticides ROUSSEL-UCLAF (FR) 1990-05-23 EP disclosed