SCHEMBL10646104

SCHEMBL10646104

O=C(NC(=O)c1ccc(F)cc1Cl)Nc1ccc(C(F)(F)F)c(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PYGL P06737 17/20 0.68
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
KDR P35968 1/20 0.50
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL10644317 0.92 PYGL (0.67) PYGLNPC1RAB9AKDRALDH1A1
SCHEMBL10746618 0.86 PYGL (0.76) PYGLNPC1RAB9AALDH1A1LMNA
SCHEMBL9622301 0.82 PYGL (0.61) PYGLNPC1RAB9A
SCHEMBL11185513 0.82 KDR (0.65) NPC1RAB9AKDRLMNASMN1; SMN2
SCHEMBL9622327 0.81 PYGL (0.62) PYGLNPC1RAB9A
SCHEMBL4556067 0.80 KDR (0.75) NPC1RAB9AKDRLMNASMN1; SMN2
SCHEMBL10746092 0.78 PYGL (0.58) PYGLNPC1RAB9AALDH1A1LMNA
SCHEMBL10746567 0.78 PYGL (0.64) PYGLNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL11626051 0.76 TDP1 (0.60) PYGLNPC1RAB9AKDRLMNA
SCHEMBL10746663 0.75 GCGR (0.55) PYGLNPC1RAB9A

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-4782091-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1988-11-01 US disclosed