SCHEMBL8976138

SCHEMBL8976138

Cn1c(-c2ccc(Cl)cc2)c(C#N)c(Cl)c1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
LMNA P02545 5/20 0.41
KDM4E B2RXH2 7/20 0.40
HPGD P15428 4/20 0.40
GAA P10253 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 2/20 0.40
GLA P06280 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
MAOA P21397 3/20 0.40
CYP11B2 P19099 2/20 0.40
CYP11B1 P15538 1/20 0.40
GRIA2 P42262 1/20 0.37
GRIA4 P48058 1/20 0.37
AR P10275 1/20 0.36
NPSR1 Q6W5P4 2/20 0.34
POLB P06746 1/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL9567382 0.89 ALDH1A1 (0.39) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL7548622 0.86 KDM4E (0.39) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL8994459 0.82 KDM4E (0.40) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL7494704 0.80 KDM4E (0.39) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL10590178 0.80 USP2 (0.44) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL9036743 0.79 KDM4E (0.38) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL5815133 0.79 KDM4E (0.36) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL5812558 0.77 RXFP1 (0.36) ALDH1A1LMNAKDM4EHPGDGAA
SCHEMBL10589580 0.77 KIF11 (0.44) ALDH1A1LMNAGAAMAOACYP11B2
Chloromethane SCHEMBL27614926 0.74 GRIA2 (0.38) ALDH1A1LMNAKDM4EGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0594942-B1 N-aminoalkylcarbonyloxyalkylpyrrole insecticidal acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-09-04 EP claimed
EP-0594940-B1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed
EP-0594941-B1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed
EP-0594940-A1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-05-04 EP claimed
US-5286741-A N-oxy- and thioalkylcarbonyloxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-02-15 US claimed
US-5563279-A Debrominative chlorination of pyrroles AMERICAN CYANAMID COMPANY (US) 1996-10-08 US disclosed
EP-0594940-B1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP disclosed
US-5449789-A Debrominative chlorination of pyrroles AMERICAN CYANAMID COMPANY (US) 1995-09-12 US disclosed
EP-0600157-A1 Debrominative chlorination of pyrroles AMERICAN CYANAMID COMPANY (US) 1994-06-08 EP disclosed
EP-0594940-A1 N-oxy- and thioalkylcarbonyloxyalkypyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-05-04 EP disclosed
US-5286741-A N-oxy- and thioalkylcarbonyloxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-02-15 US disclosed