SCHEMBL9820952

SCHEMBL9820952

[CH]1CCNC(CCCCc2ccccc2)C1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL4696384 0.88 PLG (0.43)
SCHEMBL5254367 0.78 MEN1 (0.40) SIGMAR1
SCHEMBL29139845 0.78 SIGMAR1 (0.47) SIGMAR1
SCHEMBL4679652 0.78 POLB (0.58)
SCHEMBL5563809 0.77 LTA4H (0.50) CYP19A1SIGMAR1
SCHEMBL5558725 0.77 LTA4H (0.50) CYP19A1SIGMAR1
SCHEMBL7293928 0.77 MEN1 (0.39) CYP19A1SIGMAR1
SCHEMBL10601127 0.76 POLB (0.61)
SCHEMBL7284180 0.75 SIGMAR1 (0.41) SIGMAR1
SCHEMBL14058359 0.75 POLB (0.44) SIGMAR1

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