SCHEMBL9775125

SCHEMBL9775125

Brc1ccc(COC2C=CCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.41
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
APP P05067 1/20 0.35
EPHX2 P34913 1/20 0.34
MAOB P27338 3/20 0.34
REN P00797 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
RAB9A P51151 1/20 0.32
HRH3 Q9Y5N1 1/20 0.31
MAOA P21397 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL11427031 0.82 PSEN1 (0.41) IDO1CARM1PRMT6HRH3
SCHEMBL9775057 0.81 IDO1 (0.47) IDO1CARM1PRMT6MAOBMAOA
SCHEMBL10654122 0.81 PTAFR (0.37)
SCHEMBL18616297 0.74 CARM1 (0.55) IDO1CARM1PRMT6APPEPHX2
SCHEMBL2126154 0.72 PSEN1 (0.39) CARM1PRMT6LMNAALDH1A1HRH3
SCHEMBL15748046 0.70 CTSL (0.40) ALDH1A1
SCHEMBL19432863 0.67 KMT2A (0.46) EPHX2ALDH1A1RXRARXRBRAB9A
SCHEMBL21602750 0.67 HDAC1 (0.35) ALDH1A1MAPTRAB9AHRH3
SCHEMBL10654118 0.67
SCHEMBL6436291 0.67 CARM1 (0.51) IDO1CARM1PRMT6APPEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0327492-A1 Herbicidally and plantgrowth regulatory active quinoline and pyrindine compounds CIBA-GEIGY AG (CH) 1989-08-09 EP claimed
US-5039673-A Anticoagulants, bronchodilators, vasodilators GLAXO GROUP LIMITED (GB) 1991-08-13 US disclosed
EP-0337739-A2 Use of TP-receptor antagonists to modify the action of myofibroblasts GLAXO GROUP LIMITED (GB) 1989-10-18 EP disclosed
EP-0327492-A1 Herbicidally and plantgrowth regulatory active quinoline and pyrindine compounds CIBA-GEIGY AG (CH) 1989-08-09 EP disclosed
EP-0296802-A1 Aminocyclopentyl ethers and their preparation and pharmaceutical formulation GLAXO GROUP LIMITED (GB) 1988-12-28 EP disclosed