SCHEMBL7650237

SCHEMBL7650237

[CH2]CCc1ccc(Oc2ccccc2)c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.42
SLC6A4 P31645 2/20 0.38
RIPK1 Q13546 1/20 0.38
SLC6A2 P23975 1/20 0.38
LTA4H P09960 1/20 0.37
TSHR P16473 1/20 0.37
TTR P02766 1/20 0.37
CAMK2A Q9UQM7 1/20 0.36
HTR2A P28223 1/20 0.36
SLC2A1 P11166 1/20 0.35
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL7650652 0.90 HRH1 (0.40) HRH1SLC6A4RIPK1SLC6A2LTA4H
SCHEMBL7649179 0.89 HRH1 (0.39) HRH1SLC6A4RIPK1SLC6A2LTA4H
SCHEMBL7654241 0.87 HRH1 (0.38) HRH1SLC6A4RIPK1SLC6A2LTA4H
SCHEMBL7648320 0.86 HRH1 (0.41) HRH1SLC6A4RIPK1SLC6A2LTA4H
SCHEMBL4447070 0.83 HRH1 (0.64) HRH1SLC6A4LTA4H
SCHEMBL4448343 0.80 TTR (0.51) HRH1SLC6A4RIPK1SLC6A2LTA4H
SCHEMBL536544 0.79 LTA4H (0.58) HRH1LTA4HTSHRTTRKDM4E
SCHEMBL15345849 0.79 HRH1 (0.49) HRH1SLC6A4RIPK1SLC6A2LTA4H
SCHEMBL7852798 0.79 HRH1 (0.41) HRH1SLC6A4RIPK1SLC6A2LTA4H
SCHEMBL5545669 0.78 HRH1 (0.67) HRH1SLC6A4RIPK1SLC6A2LTA4H

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6492364-B1 Triazolo and derivatives as chemokine inhibitors TORAY INDUSTRIES, INC. (JP) 2002-12-10 US disclosed
EP-1067130-A1 TRIAZOLO DERIVATIVES AND CHEMOKINE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT TORAY INDUSTRIES, INC. (JP) 2001-01-10 EP disclosed