SCHEMBL7304730

SCHEMBL7304730

COc1ccc2c(c1)C=C(CC(=O)N1CCC[C@H]1C(=O)O)C2

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.53
OPRM1 P35372 1/20 0.46
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
PSMD14 O00487 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DPP4 P27487 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ACE P12821 1/20 0.39
DGAT1 O75907 1/20 0.39

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
SCHEMBL7303343 0.84 PREP (0.56) PREPALDH1A1KMT2ASMN1; SMN2CHRM2
SCHEMBL7302086 0.81 PREP (0.77) PREPALDH1A1SMN1; SMN2CHRM2CHRM4
SCHEMBL7294777 0.81 PREP (0.77) PREPALDH1A1SMN1; SMN2CHRM2CHRM4
SCHEMBL7297629 0.78 PREP (0.76) PREPALDH1A1SMN1; SMN2CHRM2CHRM4
SCHEMBL7295355 0.78 PREP (0.78) PREPALDH1A1SMN1; SMN2CHRM2CHRM4
SCHEMBL3504947 0.77 HPGD (0.58) ALDH1A1MEN1KMT2AL3MBTL1DPP4
SCHEMBL7475648 0.77 HPGD (0.58) ALDH1A1MEN1KMT2AL3MBTL1DPP4
SCHEMBL9372814 0.77 HPGD (0.58) ALDH1A1MEN1KMT2AL3MBTL1DPP4
SCHEMBL7295370 0.75 PREP (0.71) PREPALDH1A1L3MBTL1DPP4SMN1; SMN2
SCHEMBL7302899 0.74 PREP (0.38) PREPALDH1A1DPP4NPSR1

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