SCHEMBL3515326

SCHEMBL3515326

N#Cc1ccc(Cc2ncc[nH]2)cc1Oc1ccc2c(c1)CCC2

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 16/20 0.39
FNTB P49356 16/20 0.39
CYP19A1 P11511 1/20 0.39
PGGT1B P53609 15/20 0.38
HRH3 Q9Y5N1 1/20 0.37
TAAR1 Q96RJ0 1/20 0.35

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
SCHEMBL3518902 0.99 CYP19A1 (0.40) FNTAFNTBCYP19A1PGGT1BHRH3
SCHEMBL5548771 0.82 FNTA (0.56) FNTAFNTBCYP19A1PGGT1BTAAR1
SCHEMBL8130724 0.82 TAAR1 (0.38) FNTAFNTBPGGT1BTAAR1
SCHEMBL3519840 0.81 SCN9A (0.47) FNTAFNTBPGGT1B
SCHEMBL3518730 0.80 FNTA (0.56) FNTAFNTBCYP19A1PGGT1BTAAR1
SCHEMBL3515222 0.80 FNTA (0.44) FNTAFNTBCYP19A1PGGT1BHRH3
SCHEMBL3516600 0.79 FNTA (0.37) FNTAFNTBPGGT1BTAAR1
SCHEMBL3515256 0.79 FNTA (0.46) FNTAFNTBCYP19A1PGGT1BTAAR1
SCHEMBL3515254 0.79 FNTA (0.45) FNTAFNTBPGGT1B
SCHEMBL3516306 0.77 FNTA (0.51) FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1744751-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2007-01-24 EP claimed
WO-2005089502-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2005-09-29 WO claimed
WO-2000059930-A1 A METHOD OF TREATING CANCER MERCK & CO., INC. (US) 2000-10-12 WO claimed
EP-2155197-A2 TREATMENT OF LYSOSOMAL STORAGE DISEASES Link Medicine Corporation (US) 2010-02-24 EP disclosed
WO-2008112525-A2 TREATMENT OF LYSOSOMAL STORAGE DISEASES LINK MEDICINE CORPORATION (US) 2008-09-18 WO disclosed
EP-1021188-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2000-07-26 EP disclosed
WO-1999017777-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1999-04-15 WO disclosed