SCHEMBL31472745

SCHEMBL31472745

Nc1oc2cccc(N)c2c(=O)c1-c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 10/20 0.66
CA2 P00918 10/20 0.66
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
DDR2 Q16832 1/20 0.41
CA12 O43570 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
MAPT P10636 3/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 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
SCHEMBL4261482 0.79 CA1 (1.00) CA1CA2MEN1KMT2ADDR2
SCHEMBL5128375 0.74 MEN1 (0.72) CA1CA2MEN1KMT2ADDR2
SCHEMBL29465830 0.74 MEN1 (0.72) CA1CA2MEN1KMT2ADDR2
SCHEMBL6354852 0.72 MAOA (0.63) CA1CA2DDR2MAPTKDM4E
SCHEMBL22273763 0.71 CA1 (0.73) CA1CA2MEN1KMT2ADDR2
SCHEMBL2409142 0.70 ESR1 (0.75) CA1CA2MEN1KMT2ACA12
SCHEMBL28647363 0.70 ALDH1A1 (0.42) CA1CA2MEN1KMT2AMAPT
SCHEMBL11464519 0.70 NPC1 (0.42) CA1CA2MEN1KMT2AMAPT
SCHEMBL22137038 0.68 ALDH1A1 (0.54) CA1CA2DDR2ESR1ESR2
SCHEMBL10756036 0.67 CYP3A4 (0.41) MAPTESR1ESR2KDM4ECYP3A4

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
CN-119390943-A Polyether amine modified epoxy curing agent and preparation method thereof 江苏三木化工股份有限公司 2025-02-07 CN disclosed