SCHEMBL9211888

SCHEMBL9211888

CC(=O)NCC1CN(c2ccc3ccccc3c2)C(=O)O1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.60
MAOB P27338 3/20 0.60
PTGS1 P23219 2/20 0.60
SDHA P31040 2/20 0.60
LMNA P02545 1/20 0.60
CALML3 P27482 1/20 0.60
F10 P00742 4/20 0.51
ABCB11 O95342 1/20 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
SCHEMBL9213579 0.85 MAOB (0.47) MAOAMAOBPTGS1SDHALMNA
SCHEMBL27951203 0.85 F10 (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6097066 0.85 F10 (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9029466 0.85 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8788012 0.84 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL19250587 0.84 MAOA (0.58) MAOAMAOBPTGS1SDHALMNA
Hydrochloric Acid SCHEMBL8695876 0.84 MAOA (0.54) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8789075 0.84 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9550276 0.83 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9550299 0.83 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0425209-B1 Naphthyloxazolidone derivatives TANABE SEIYAKU CO (JP) 1995-05-10 EP disclosed
US-5332754-A Antidepressant TANABE SEIYAKU CO., LTD. (JP) 1994-07-26 US disclosed
US-5182296-A Antidepressants TANABE SEIYAKY CO., LTD. (JP) 1993-01-26 US disclosed
EP-0425209-A2 Naphthyloxazolidone derivatives TANABE SEIYAKU CO., LTD. (JP) 1991-05-02 EP disclosed