SCHEMBL10499152

SCHEMBL10499152

C=Cc1c(Cl)cccc1Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.53
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 4/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
NR1H2 P55055 1/20 0.40
TSHR P16473 2/20 0.39
HPGD P15428 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPK8 P45983 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
FABP3 P05413 1/20 0.38
FABP4 P15090 1/20 0.38

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
SCHEMBL2196342 0.87 ALDH1A1 (0.43) DPP4MAPTALDH1A1LMNAL3MBTL1
SCHEMBL7770741 0.82 ALDH1A1 (0.55) DPP4MAPTPOLBALDH1A1NPSR1
SCHEMBL467502 0.80 LMNA (0.52) DPP4ALDH1A1LMNAL3MBTL1GAA
SCHEMBL3790160 0.76 DPP4 (0.62) DPP4MAPTPOLBALDH1A1NPSR1
SCHEMBL11500020 0.76 DPP4 (0.63) DPP4MAPTPOLBALDH1A1NPSR1
SCHEMBL18718123 0.76 NFE2L2 (0.41) MAPTALDH1A1LMNAL3MBTL1KMT2A
SCHEMBL2465320 0.76 DPP4 (0.58) DPP4MAPTPOLBALDH1A1NPSR1
SCHEMBL3667279 0.75 DPP4 (0.61) DPP4MAPTPOLBALDH1A1NPSR1
Ammonia Solution, Strong SCHEMBL4267774 0.74 DPP4 (0.60) DPP4MAPTPOLBALDH1A1NPSR1
SCHEMBL181965 0.73 ALDH1A1 (0.55) MAPTPOLBALDH1A1NPSR1LMNA

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-4835312-A Production process of N-substituted amide compounds MITSUI CHEMICALS, INCORPORATED (JP) 1989-05-30 US disclosed