SCHEMBL9820696

SCHEMBL9820696

CN=C1c2c(O)ccc(C)c2C2CCCCC12

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.31
MAOB P27338 2/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL9820690 1.00 MAOA (0.31) MAOAMAOBKMT2A
SCHEMBL9820652 0.78 MAOA (0.39) MAOAMAOBKMT2A
SCHEMBL9869957 0.76 CYP1A2 (0.35) KMT2A
SCHEMBL9869965 0.76 CYP1A2 (0.35) KMT2A
SCHEMBL9820813 0.73 MAOA (0.42) MAOAKMT2A
SCHEMBL9820650 0.69 MAOA (0.31) MAOA
SCHEMBL9820645 0.69 MAOA (0.31) MAOA
SCHEMBL15773671 0.66 NPC1 (0.35) KMT2A
SCHEMBL5615886 0.65 ACMSD (0.37)
SCHEMBL8494999 0.64 ACMSD (0.39)

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
US-5017724-A Antihypoxic, CNS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-05-21 US disclosed
EP-0267024-B1 HYDROFLUORENE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-05-02 EP disclosed
EP-0267024-A2 Hydrofluorene derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-05-11 EP disclosed