SCHEMBL10569749

SCHEMBL10569749

CCOC(=O)c1cncn1Cc1cccc(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 4/20 0.46
GABRA1 P14867 4/20 0.46
GABRB2 P47870 4/20 0.46
CYP11B1 P15538 3/20 0.46
CYP1A2 P05177 3/20 0.46
CYP3A4 P08684 2/20 0.46
LMNA P02545 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
ABCB11 O95342 1/20 0.46
GABRA2 P47869 1/20 0.46
ALDH1A1 P00352 5/20 0.40
MAPT P10636 3/20 0.40
KDM4E B2RXH2 5/20 0.39
POLB P06746 1/20 0.39
TP53 P04637 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL10564954 0.86 CYP11B2 (0.48) CYP11B2GABRA1GABRB2CYP11B1CYP1A2
SCHEMBL9714409 0.81 AURKA (0.40) LMNA
SCHEMBL16380792 0.77 CYP11B1 (0.57) CYP11B2GABRA1GABRB2CYP11B1CYP1A2
SCHEMBL2438549 0.77 CYP11B2 (0.48) CYP11B2GABRA1GABRB2CYP11B1CYP1A2
SCHEMBL898835 0.76 GABRA1 (0.50) CYP11B2GABRA1GABRB2CYP11B1CYP1A2
SCHEMBL24793268 0.74 GABRA1 (0.52) CYP11B2GABRA1GABRB2CYP11B1CYP1A2
SCHEMBL10771365 0.74 ALKBH1 (0.40) CYP11B2CYP11B1LMNAGAA
SCHEMBL10567701 0.74 CYP1A2 (0.43) GABRB2CYP1A2LMNAGABRA2ALDH1A1
SCHEMBL14476466 0.73 CYP11B2 (0.54) CYP11B2GABRA1GABRB2CYP11B1CYP1A2
SCHEMBL15652817 0.73 CYP11B1 (0.54) CYP11B2GABRA1GABRB2CYP11B1CYP1A2

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-4851424-A 1-Phenyl-lower alkyl-imidazole 4- or 5-carboxamide compounds which are useful in the treatment of epilepsy CIBA-GEIGY CORPORATION (US) 1989-07-25 US disclosed