SCHEMBL29656790

SCHEMBL29656790

FC(F)(F)c1cc(C(F)(F)F)c2ccncc2c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.45
CHUK O15111 1/20 0.44
TRPV1 Q8NER1 5/20 0.43
KDM5A P29375 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
CACNA1H O95180 2/20 0.40
CACNA1G O43497 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LATS1 O95835 2/20 0.39
CYP1A2 P05177 2/20 0.38
METAP2 P50579 2/20 0.38
LATS2 Q9NRM7 1/20 0.37
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
P2RX1 P51575 1/20 0.36

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
SCHEMBL23301079 1.00 KIF11 (0.45) KIF11CHUKTRPV1KDM5AKDM4C
SCHEMBL5656993 0.81 CYP1A2 (0.49) KIF11CHUKTRPV1KDM5AKDM4C
SCHEMBL28489057 0.81 KIF11 (0.44) KIF11CHUKTRPV1KDM5AKDM4C
SCHEMBL30218963 0.81 CYP1A2 (0.49) KIF11CHUKTRPV1KDM5AKDM4C
SCHEMBL18350679 0.75 TRPV1 (0.42) KIF11TRPV1LATS1LATS2S1PR1
SCHEMBL11137238 0.74 KDM4E (0.58) TRPV1KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL25625876 0.74 KIF11 (0.55) KIF11CHUKTRPV1KDM5AKDM4C
Benzene SCHEMBL27527500 0.73 KDM4E (0.57) TRPV1KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL31478776 0.72 KIF11 (0.49) KIF11CHUKMETAP2
SCHEMBL11139756 0.72 KIF11 (0.49) KIF11CHUKMETAP2

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-114630825-B Condensed with pesticidal activity bicyclic heteroaromatic compounds 先正达农作物保护股份公司 2025-05-16 CN disclosed
CN-114630825-A Pesticidally active fused bicyclic heteroaromatic compounds 先正达农作物保护股份公司 2022-06-14 CN disclosed