SCHEMBL9057679

SCHEMBL9057679

N#CCn1c(-c2ccc(Cl)cc2)c(C#N)c(Br)c1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
LMNA P02545 2/20 0.36
GLA P06280 2/20 0.36
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.36
CRHBP P24387 1/20 0.36
KMT2A Q03164 1/20 0.36
CRHR2 Q13324 1/20 0.36
CNR1 P21554 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
GRIA2 P42262 1/20 0.32
GRIA4 P48058 1/20 0.32
USP2 O75604 1/20 0.31
THRB P10828 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RXFP1 Q9HBX9 2/20 0.30

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
SCHEMBL9055167 0.90 ALDH1A1 (0.32) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7508068 0.88 KDM4E (0.37) HTTKDM4EALDH1A1HPGDLMNA
SCHEMBL7499361 0.88 KDM4E (0.37) HTTKDM4EALDH1A1HPGDLMNA
SCHEMBL5819212 0.84 KDM4E (0.34) HTTKDM4EALDH1A1HPGDLMNA
SCHEMBL27916628 0.82 KDM4E (0.33) HTTKDM4EALDH1A1HPGDLMNA
SCHEMBL9279148 0.82 POLB (0.34) HTTKDM4EALDH1A1HPGDLMNA
Chlorfenapyr SCHEMBL40337 0.82 RXFP1 (0.35) HTTKDM4EALDH1A1HPGDLMNA
Chlorfenapyr SCHEMBL28530561 0.81 RXFP1 (0.35) HTTKDM4EALDH1A1HPGDLMNA
Chlorfenapyr SCHEMBL27488880 0.81 RXFP1 (0.35) HTTKDM4EALDH1A1HPGDLMNA
SCHEMBL9460941 0.81 POLB (0.36) HTTKDM4EALDH1A1HPGDLMNA

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
EP-0426948-B1 Arylpyrrole insecticidal acaricidal and nematicidal agents and methods AMERICAN CYANAMID CO (US) 1996-05-08 EP disclosed