SCHEMBL9840560

SCHEMBL9840560

CCOCn1c(C#N)c(Cl)c(Cl)c1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.37
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
NAAA Q02083 1/20 0.32
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32
AR P10275 1/20 0.32
ADORA1 P30542 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
MAPK14 Q16539 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31
CRHBP P24387 1/20 0.31

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
SCHEMBL8072565 0.82 KIF11 (0.36) KIF11CTSSCTSKNAAAADORA1
SCHEMBL5819960 0.81 KIF11 (0.35) KIF11CTSSCTSKNAAAADORA1
SCHEMBL9567369 0.78 KIF11 (0.33) KIF11CTSSCTSKADORA1MAPT
SCHEMBL5813013 0.74 KIF11 (0.35) KIF11CTSSCTSKNAAAADORA1
SCHEMBL9388094 0.73
SCHEMBL5812558 0.72 RXFP1 (0.36) KDM4EMEN1MAPTCRHBPKMT2A
SCHEMBL5819964 0.71 MAOA (0.34) ARADORA1KDM4EMEN1MAPT
SCHEMBL9567356 0.71 KIF11 (0.33) KIF11CTSSCTSK
SCHEMBL8532395 0.71 KDM4E (0.38) ARKDM4EMEN1MAPTCRHBP
Hydrochloric Acid SCHEMBL28752946 0.70 KDM4E (0.37) ARKDM4EMEN1MAPTCRHBP

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-5010098-A Arylpyrrole insecticidal acaricidal and nematicidal agents and methods for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1991-04-23 US claimed