SCHEMBL9580552

SCHEMBL9580552

CC(C=CC1C(F)C1c1cc(Cl)c(Cl)c(Cl)c1)=CC(=O)NCC(C)C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
CNR2 P34972 4/20 0.30
PPARG P37231 2/20 0.30
PPARD Q03181 2/20 0.30
PPARA Q07869 2/20 0.30
CNR1 P21554 2/20 0.30
TRPV1 Q8NER1 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL9580493 0.90 HPGD (0.41) KDM4EHPGDLMNASMN1; SMN2TRPV1
SCHEMBL9580471 0.81 HPGD (0.32) HPGDSMN1; SMN2TRPV1
SCHEMBL9517809 0.81 CETP (0.40) KDM4EHPGDLMNASMN1; SMN2CNR2
SCHEMBL9516776 0.81 CETP (0.40) KDM4EHPGDLMNASMN1; SMN2CNR2
SCHEMBL9516782 0.81 CETP (0.40) KDM4EHPGDLMNASMN1; SMN2CNR2
SCHEMBL9430134 0.78 HPGD (0.42) KDM4EHPGDLMNASMN1; SMN2TRPV1
SCHEMBL9580671 0.78 HPGD (0.42) KDM4EHPGDLMNASMN1; SMN2TRPV1
SCHEMBL9430398 0.78 HPGD (0.42) KDM4EHPGDLMNASMN1; SMN2TRPV1
SCHEMBL9580457 0.78 HPGD (0.42) KDM4EHPGDLMNASMN1; SMN2TRPV1
SCHEMBL9516830 0.75 EPHX2 (0.34) KDM4EHPGDLMNATRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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