SCHEMBL11469880

SCHEMBL11469880

CCCCC(C#N)(Cn1ccnc1)c1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
FNTA P49354 5/20 0.39
FNTB P49356 5/20 0.39
PGGT1B P53609 1/20 0.39
HSP90AA1 P07900 1/20 0.39
CYP11B1 P15538 2/20 0.38
CYP11B2 P19099 2/20 0.38
CYP19A1 P11511 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
GAA P10253 2/20 0.37
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
TBXAS1 P24557 2/20 0.37
QPCT Q16769 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL11480362 0.83 ALDH1A1 (0.41) POLBHSP90AA1CYP11B1CYP11B2CYP19A1
SCHEMBL11472531 0.83 FNTA (0.42) FNTAFNTBPGGT1BHSP90AA1CYP11B1
SCHEMBL21421 0.82 CYP11B1 (0.52) POLBHSP90AA1CYP11B1CYP11B2CYP19A1
SCHEMBL11469917 0.78 HSP90AA1 (0.39) POLBFNTAFNTBPGGT1BHSP90AA1
SCHEMBL11242742 0.76 OGG1 (0.47) FNTAFNTBPGGT1BHSP90AA1CYP11B1
SCHEMBL9804757 0.76 TLR7 (0.36) L3MBTL1KDM4E
SCHEMBL11352932 0.76 POLB (0.45) POLBFNTAFNTBHSP90AA1CYP11B1
SCHEMBL11348607 0.76 POLB (0.45) POLBFNTAFNTBHSP90AA1CYP11B1
SCHEMBL11354100 0.75 HSP90AA1 (0.42) POLBHSP90AA1CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL11472555 0.75 OGG1 (0.47) FNTAFNTBPGGT1BHSP90AA1KMT2A

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
US-4225723-A Process for the preparation of substituted arylcyanoalkyl and diaryl cyanoalkylimidazoles ROHM AND HAAS COMPANY (US) 1980-09-30 US disclosed
US-4143137-A SUBSTITUTED ARYLCYANOALKYL AND DIARYLCYANOALKYLIMIDAZOLE METAL SALT COMPLEXES AND FUNGICIDAL COMPOSITIONS AND METHODS UTILIZING THEM ROHM AND HAAS COMPANY (US) 1979-03-06 US disclosed