SCHEMBL28116860

SCHEMBL28116860

O=CC(Cc1cccc(O)c1)c1cccc(O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.43
SLC6A3 Q01959 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
ADRB1 P08588 2/20 0.41
ADRA1A P35348 2/20 0.41
MIF P14174 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2B P41595 1/20 0.41
GRIA2 P42262 1/20 0.41
DRD1 P21728 2/20 0.41
HIF1A Q16665 2/20 0.41
LMNA P02545 2/20 0.41
DRD2 P14416 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
GALR3 O60755 1/20 0.41
NFKB1 P19838 2/20 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
SCHEMBL28837424 0.80 ENPP2 (0.40) ENPP2SLC6A3SLC6A2SLC6A4CHRM2
SCHEMBL9714681 0.79 HIF1A (0.50) SLC6A3ADRB1ADRA1AMIFHTR2A
SCHEMBL15652787 0.79 KYNU (0.44) ENPP2SLC6A3ADRB1ADRA1AMIF
SCHEMBL19609050 0.77 ENPP2 (0.47) ENPP2CHRM2CHRM1CHRM3GRIA2
SCHEMBL31589346 0.77 ENPP2 (0.50) ENPP2SLC6A3SLC6A2SLC6A4CHRM2
SCHEMBL28048068 0.75 HIF1A (0.61) SLC6A3ADRB1ADRA1AMIFHTR2A
SCHEMBL28837384 0.75 ENPP2 (0.46) ENPP2SLC6A3SLC6A2SLC6A4CHRM2
SCHEMBL28116858 0.75 GRIA2 (0.45) ENPP2SLC6A3SLC6A2SLC6A4ADRB1
SCHEMBL27898186 0.74 ACHE (0.44) LMNAKMT2AKDM4EMAPT
SCHEMBL5658423 0.72 SLC7A5 (0.44) KMT2A

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-106547168-A A kind of black-matrix material compositionss and application 深圳市华星光电技术有限公司 2017-03-29 CN disclosed