SCHEMBL7302732

SCHEMBL7302732

O=C(C1CCc2ccccc2C1)C1C(=S)CN[C@@H]1C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.43
PREP P48147 10/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
ACE P12821 1/20 0.37
ITGB3 P05106 1/20 0.35
ITGB1 P05556 1/20 0.35
ITGAV P06756 1/20 0.35
ITGA5 P08648 1/20 0.35
ITGA4 P13612 1/20 0.35
FAAH O00519 2/20 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
SCHEMBL9045747 0.85 F2 (0.38) F2PREP
SCHEMBL7303470 0.85 F2 (0.38) F2PREP
SCHEMBL9049813 0.85 F2 (0.38) F2PREP
SCHEMBL9046319 0.85 CHRM2 (0.40) F2PREPCHRM2CHRM4CHRM1
SCHEMBL9048167 0.85 CHRM2 (0.40) F2PREPCHRM2CHRM4CHRM1
SCHEMBL7300734 0.85 PREP (0.42) F2PREPCHRM2CHRM4CHRM1
SCHEMBL9048919 0.85 PREP (0.49) PREP
SCHEMBL9048069 0.85 PREP (0.49) PREP
SCHEMBL7301200 0.84 FAAH (0.38) FAAH
SCHEMBL9171243 0.83 F2 (0.35) F2PREPFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0372484-B1 Condensed benzene derivative ZERIA PHARM CO LTD (JP) 1994-10-26 EP disclosed
US-5028604-A Cognition Activators ZERIA PHARMACEUTICAL CO., LTD. (JP) 1991-07-02 US disclosed
EP-0372484-A2 Condensed benzene derivative ZERIA PHARMACEUTICAL CO., LTD. (JP) 1990-06-13 EP disclosed