SCHEMBL30979264

SCHEMBL30979264

Oc1cccc(Cc2cccc(O)c2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.65
DRD2 P14416 2/20 0.60
DRD1 P21728 2/20 0.60
TAAR1 Q96RJ0 1/20 0.60
CYP3A4 P08684 2/20 0.58
LMNA P02545 2/20 0.58
CA12 O43570 1/20 0.58
ALDH1A1 P00352 1/20 0.58
CA2 P00918 1/20 0.58
CA5A P35218 1/20 0.58
CA9 Q16790 1/20 0.58
HSD17B10 Q99714 1/20 0.58
CA14 Q9ULX7 1/20 0.58
CA5B Q9Y2D0 1/20 0.58
CYP1A2 P05177 1/20 0.58
PKM P14618 1/20 0.58
ALOX15 P16050 1/20 0.58
NFKB1 P19838 1/20 0.58
MAPK1 P28482 1/20 0.58
KMT2A Q03164 1/20 0.56

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
SCHEMBL70267 1.00 ENPP2 (0.65) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL30471604 0.93 IDH1 (0.59) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL1531575 0.93 IDH1 (0.59) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL921375 0.91 ESR1 (0.64) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL18174858 0.87 ACHE (0.64) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL21005021 0.87 ENPP2 (0.52) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL9221725 0.87 CA2 (0.64) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL13971733 0.85 KMT2A (0.55) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL17243694 0.85 IDH1 (0.51) ENPP2DRD2DRD1TAAR1CYP3A4
SCHEMBL18466196 0.85 ENPP2 (0.50) ENPP2DRD2DRD1TAAR1CYP3A4

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-118076767-A Method and formulation for producing an optical metal oxide layer 默克专利有限公司 2024-05-24 CN disclosed