SCHEMBL9480201

SCHEMBL9480201

COc1cc(C#N)c[c]n1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.36
HPGDS O60760 2/20 0.33

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
SCHEMBL9481160 0.80 GABRG2 (0.40)
SCHEMBL9481270 0.71
SCHEMBL7170537 0.71
SCHEMBL8655905 0.71 ALDH1A1 (0.38)
SCHEMBL9480093 0.71 MAOB (0.55)
SCHEMBL7168717 0.69
SCHEMBL9480780 0.69 KMT2A (0.40)
SCHEMBL4884574 0.67 ALDH1A1 (0.32)
SCHEMBL447719 0.67 LOX (0.47) HPGDS
SCHEMBL17069067 0.67 GRM5 (0.49) RECQLHPGDS

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-0247381-B1 5-FLUROROURACIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-04 EP disclosed
US-5047521-A Anticarcinogenic agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 US disclosed
EP-0247381-A2 5-flurorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-12-02 EP disclosed