SCHEMBL10568262

SCHEMBL10568262

CCOC(=O)c1cn(Cc2c(F)cccc2F)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 4/20 0.48
CYP1A2 P05177 1/20 0.47
NOTUM Q6P988 1/20 0.44
GAA P10253 1/20 0.43
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 2/20 0.41
ALOX15 P16050 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CA5A P35218 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
EED O75530 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL10568102 0.87 MEN1 (0.46) ALDH1A1KDM4ECYP1A2LMNACA5A
SCHEMBL10567701 0.86 CYP1A2 (0.43) ALDH1A1KDM4ECYP1A2NOTUMGAA
SCHEMBL2440579 0.85 NOTUM (0.53) ALDH1A1KDM4ECYP1A2NOTUMGAA
SCHEMBL15956806 0.81 KDM4C (0.52) ALDH1A1KDM4ECYP1A2NOTUMLMNA
SCHEMBL12179543 0.81 CA5A (0.46) ALDH1A1KDM4ECA5A
SCHEMBL9248509 0.80 LMNA (0.60) ALDH1A1CYP1A2NOTUMLMNASMN1; SMN2
SCHEMBL30587618 0.80 ALDH1A1 (0.47) ALDH1A1NOTUMLMNASMN1; SMN2HPGD
SCHEMBL9714146 0.80 CA5A (0.58) CA5A
SCHEMBL9714332 0.80 KLKB1 (0.44) ALDH1A1LMNACA5A
SCHEMBL10570251 0.79 ALDH1A1 (0.48) ALDH1A1KDM4ENOTUMLMNASMN1; SMN2

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