SCHEMBL8614715

SCHEMBL8614715

O=C(O)C=C1c2ccccc2COc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 5/20 0.50
ALDH1A1 P00352 4/20 0.50
KCNH2 Q12809 2/20 0.50
HTR2B P41595 2/20 0.50
KMT2A Q03164 2/20 0.50
SLC22A1 O15245 1/20 0.50
CHRM2 P08172 1/20 0.50
CHRM4 P08173 1/20 0.50
HTR1A P08908 1/20 0.50
CHRM5 P08912 1/20 0.50
ADRA2A P08913 1/20 0.50
CHRM1 P11229 1/20 0.50
DRD2 P14416 1/20 0.50
ADRA2B P18089 1/20 0.50
ADRA2C P18825 1/20 0.50
CHRM3 P20309 1/20 0.50
DRD1 P21728 1/20 0.50
DRD4 P21917 1/20 0.50
DRD5 P21918 1/20 0.50
SLC6A2 P23975 1/20 0.50

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
SCHEMBL8614712 1.00 HRH1 (0.50) HRH1ALDH1A1KCNH2HTR2BKMT2A
SCHEMBL8143121 0.84 TBXA2R (0.53)
SCHEMBL8143124 0.84 TBXA2R (0.53)
SCHEMBL9601162 0.83 HRH1 (0.44) HRH1ALDH1A1KCNH2HTR2BKMT2A
SCHEMBL8137785 0.82 AKR1B1 (0.54) HRH1LMNA
SCHEMBL8137781 0.82 AKR1B1 (0.54) HRH1LMNA
SCHEMBL8142196 0.81 AKR1B1 (0.53) HRH1LMNA
SCHEMBL8142200 0.81 AKR1B1 (0.53) HRH1LMNA
SCHEMBL11119074 0.79 RAB9A (0.49) HRH1ALDH1A1KCNH2HTR2BSLC22A1
SCHEMBL2749071 0.79 TOP1 (0.42) ALDH1A1KMT2AMEN1KDM4EMAPK1

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
EP-0588608-B1 Tricyclic compounds and pharmaceutical compositions containing them KYOWA HAKKO KOGYO KK (JP) 1998-05-06 EP disclosed
EP-0588608-A2 Tricyclic compounds and pharmaceutical compositions containing them KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-03-23 EP disclosed