SCHEMBL7297481

SCHEMBL7297481

O=C(O)[C@@H]1CCCN1C(=O)C1Cc2ccccc2C1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
F2 P00734 1/20 0.52
PREP P48147 8/20 0.51
ACE P12821 3/20 0.51
CHRM2 P08172 1/20 0.49
CHRM4 P08173 1/20 0.49
CHRM1 P11229 1/20 0.49
CHRM3 P20309 1/20 0.49
ITGB3 P05106 1/20 0.49
ITGB1 P05556 1/20 0.49
ITGAV P06756 1/20 0.49
ITGA5 P08648 1/20 0.49
ITGA4 P13612 1/20 0.49

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
SCHEMBL7295630 0.93 F2 (0.60) ALDH1A1SMN1; SMN2F2PREPACE
SCHEMBL7294364 0.89 F2 (0.56) ALDH1A1SMN1; SMN2F2PREPACE
SCHEMBL7302867 0.85 PREP (0.68) PREP
SCHEMBL7302878 0.85 PREP (0.68) PREP
SCHEMBL7303538 0.81 F2 (0.49) ALDH1A1F2PREP
SCHEMBL6435625 0.81 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2PREPACECHRM2
SCHEMBL6435623 0.81 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2PREPACECHRM2
SCHEMBL7303542 0.81 F2 (0.49) ALDH1A1F2PREP
SCHEMBL9049117 0.80 PREP (0.71) PREP
SCHEMBL9049114 0.80 PREP (0.71) PREP

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