SCHEMBL9015109

SCHEMBL9015109

N#Cc1c(-c2ccc(OC(F)(F)C(F)F)cc2)[nH]c(C(F)(F)F)c1-c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 4/20 0.41
GLA P06280 3/20 0.41
LMNA P02545 3/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 2/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
MAPT P10636 3/20 0.34
PSD A5PKW4 1/20 0.34
TRPV1 Q8NER1 2/20 0.34
AR P10275 1/20 0.34
IDO1 P14902 1/20 0.34
MET P08581 1/20 0.34
ARF6 P62330 1/20 0.33
GRM5 P41594 2/20 0.33
ADORA1 P30542 1/20 0.33

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
SCHEMBL9446496 0.88 IDO1 (0.37) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL9015062 0.86 KDM4E (0.48) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL9840681 0.85 KDM4E (0.38) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL9446485 0.81 GRM5 (0.47) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL9224576 0.77 ALDH1A1 (0.49) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL9446465 0.77 ALDH1A1 (0.45) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL9446464 0.77 ALDH1A1 (0.45) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL1180132 0.76 ALDH1A1 (0.48) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL9189605 0.74 ALDH1A1 (0.47) ALDH1A1KDM4EGLALMNAGAA
SCHEMBL13858869 0.73 ALDH1A1 (0.46) ALDH1A1KDM4EGLALMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0487870-B1 Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID CO (US) 1996-12-18 EP claimed
US-5233052-A Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds AMERICAN CYANAMID COMPANY (US) 1993-08-03 US disclosed
US-5180734-A INSECTICIDAL AND ACARICIDAL DIARYLPYRROLECARBONITRILE AND DIARYLNITROPYRROLE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1993-01-19 US disclosed