SCHEMBL3686705

SCHEMBL3686705

N#Cc1cccc(Cn2ccnc2)c1Oc1cccc2cc[nH]c12

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.54
FNTA P49354 15/20 0.47
FNTB P49356 15/20 0.47
PGGT1B P53609 15/20 0.47
CYP11B1 P15538 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL3501097 0.81 FNTA (0.72) FNTAFNTBPGGT1B
SCHEMBL88059 0.72 CYP19A1 (1.00) CYP19A1FNTAFNTBPGGT1BCYP11B1
Hydrochloric Acid SCHEMBL1507826 0.71 CYP19A1 (0.97) CYP19A1FNTAFNTBPGGT1BCYP11B1
SCHEMBL3502730 0.65 FNTA (0.72) FNTAFNTBPGGT1B
Acetic Acid SCHEMBL2789778 0.65 CYP19A1 (0.81) CYP19A1FNTAFNTBPGGT1BCYP11B1
SCHEMBL7841243 0.65 CYP19A1 (0.68) CYP19A1FNTAFNTBPGGT1BCYP11B1
SCHEMBL3686703 0.65 FNTA (0.33) FNTAFNTBPGGT1B
SCHEMBL3501696 0.64 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL29361477 0.64 AHR (0.50)
SCHEMBL1420318 0.64 AHR (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010057028-A9 TREATMENT OF PROTEINOPATHIES USING A FARNESYL TRANSFERASE INHIBITOR LINK MEDICINE CORPORATION (US) 2010-09-02 WO disclosed
WO-2010057028-A2 TREATMENT OF PROTEINOPATHIES USING A FARNESYL TRANSFERASE INHIBITOR LINK MEDICINE CORPORATION (US) 2010-05-20 WO disclosed