SCHEMBL31707307

SCHEMBL31707307

C=C(O)C(=O)n1nc2ccccc2n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
MGAM O43451 3/20 0.34
KMT2A Q03164 2/20 0.33
F2 P00734 1/20 0.33
AMY1A P0DUB6 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
SLC9A1 P19634 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
PARP1 P09874 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
TSHR P16473 1/20 0.32
EGLN3 Q9H6Z9 2/20 0.32

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
SCHEMBL523395 0.78 HPGD (0.46) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL8156271 0.72 HPGD (0.50) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL20144332 0.72 KDM4E (0.38) HPGDKDM4EALDH1A1MAPTHSD17B10
SCHEMBL8143932 0.71 NPC1 (0.44) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL11883102 0.71 PARP1 (0.40) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL14516233 0.71 KDM4E (0.39) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL3689757 0.71 KDM4E (0.40) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL19733536 0.70 KDM4E (0.43) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL23047587 0.68 KDM4E (0.38) HPGDKDM4EHSD17B10TSHRNPC1
SCHEMBL11294552 0.68 SMN1; SMN2 (0.48) KDM4EALDH1A1SMN1; SMN2MAPTKMT2A

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-120795274-A Preparation method and application of reinforced polyurethane resin for photovoltaic frame 福建省闽发铝业股份有限公司 2025-10-17 CN disclosed