SCHEMBL8728467

SCHEMBL8728467

O=C(O)CC1Cc2ccc(OCc3ccccc3)cc2C1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.60
ITGA2B P08514 1/20 0.60
FFAR1 O14842 3/20 0.59
FAAH O00519 7/20 0.50
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
RXRG P48443 2/20 0.50
HRH3 Q9Y5N1 3/20 0.49
CYP2D6 P10635 1/20 0.49
HRH1 P35367 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48

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
SCHEMBL12471689 0.85 HRH3 (0.52) FAAHHRH3CYP2D6HRH1MAOA
SCHEMBL3450818 0.83 ITGB3 (0.72) ITGB3ITGA2BFFAR1FAAHRXRA
SCHEMBL12471199 0.81 HRH3 (0.51) FAAHHRH3CYP2D6HRH1MAOA
SCHEMBL4622244 0.80 ITGB3 (0.68) ITGB3ITGA2BFFAR1FAAHRXRA
SCHEMBL4045668 0.80 MAOA (0.52) FAAHHRH3CYP2D6HRH1MAOA
SCHEMBL14263757 0.80 MAOA (0.52) FAAHHRH3CYP2D6HRH1MAOA
SCHEMBL7303640 0.79 ITGB3 (0.70) ITGB3ITGA2BFFAR1RXRARXRB
SCHEMBL4623073 0.79 ITGB3 (0.74) ITGB3ITGA2BFFAR1FAAHRXRA
SCHEMBL12472053 0.79 FAAH (0.59) FAAHHRH3
SCHEMBL10226240 0.79 CYP19A1 (0.54) ITGB3ITGA2BFFAR1

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
US-5750524-A ADMINISTERING AN SULFAMIDE SUBSTITUTED INDAN DERIVATIVE ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
EP-0773019-A1 HYPERLIPEMIA REMEDY ZERIA PHARMACEUTICAL CO., LTD. (JP) 1997-05-14 EP disclosed
EP-0589037-B1 INDIAN DERIVATIVE AND THROMBOXANE ANTAGONIST CONTAINING THE SAME ZERIA PHARM CO LTD (JP) 1996-05-29 EP disclosed
US-5409956-A A sulfonylaminoalkylindan carboxylic acid or ester for treating thrombosis, vasospasm or asthma ZERIA PHARMACEUTICAL CO., LTD. (JP) 1995-04-25 US disclosed
EP-0589037-A1 INDIAN DERIVATIVE AND THROMBOXANE ANTAGONIST CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1994-03-30 EP disclosed