SCHEMBL7976745

SCHEMBL7976745

Cc1ccc(CNC([NH])=O)o1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
MAPT P10636 6/20 0.50
PKM P14618 4/20 0.50
CHRM2 P08172 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
POLB P06746 2/20 0.46
ALOX5 P09917 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CYP3A4 P08684 2/20 0.46
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
APOBEC3A P31941 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL7976747 0.87 ALOX5 (0.53) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL18415480 0.86 ALDH1A1 (0.51) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL10061717 0.85 MAPT (0.50) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL27357988 0.81 PKM (0.52) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL33528965 0.81 ALDH1A1 (0.50) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL19712892 0.80 ALDH1A1 (0.55) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL20194513 0.80 CHRM2 (0.49) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL12017893 0.80 PKM (0.47) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL10310214 0.79 CHRM2 (0.47) ALDH1A1MAPTPKMCHRM2CYP1A2
SCHEMBL12093535 0.78 TDP1 (0.61) ALDH1A1MAPTPKMPOLBMEN1

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
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed