SCHEMBL14357929

SCHEMBL14357929

[c]1cncc2c1Nc1ccccc1S2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.56
GAA P10253 7/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
IDO1 P14902 1/20 0.56
NOX1 Q9Y5S8 10/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
ALOX15 P16050 3/20 0.52
SNCA P37840 3/20 0.52
BCHE P06276 2/20 0.52
ACHE P22303 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
CYP1A2 P05177 2/20 0.52
POLB P06746 1/20 0.52
CYP3A4 P08684 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
ALOX12 P18054 1/20 0.52
MAOA P21397 1/20 0.52
CNR1 P21554 1/20 0.52
PTGS1 P23219 1/20 0.52

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
SCHEMBL4651 0.75 NOX1 (0.59) MAPTGAAL3MBTL1IDO1NOX1
SCHEMBL28535050 0.74 NOX1 (0.57) MAPTGAAL3MBTL1IDO1NOX1
SCHEMBL407793 0.72 MAPT (1.00) MAPTGAAL3MBTL1IDO1NOX1
SCHEMBL15539144 0.71 NOX1 (0.48) MAPTGAAL3MBTL1IDO1NOX1
Phenothiazine SCHEMBL29349533 0.71 NOX1 (1.00) MAPTGAAL3MBTL1IDO1NOX1
Phenothiazine SCHEMBL6315328 0.71 NOX1 (1.00) MAPTGAAL3MBTL1IDO1NOX1
Phenothiazine SCHEMBL2504207 0.71 NOX1 (1.00) MAPTGAAL3MBTL1IDO1NOX1
Phenothiazine SCHEMBL29352248 0.71 NOX1 (1.00) MAPTGAAL3MBTL1IDO1NOX1
Phenothiazine SCHEMBL9114 0.71 NOX1 (1.00) MAPTGAAL3MBTL1IDO1NOX1
SCHEMBL28860617 0.70 NOX1 (0.52) MAPTGAAL3MBTL1IDO1NOX1

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
CN-116744941-A RNA production 生物技术欧洲股份公司 2023-09-12 CN disclosed
WO-2013003697-A1 METHOD FOR CONTROLLING TUMOR GROWTH, ANGIOGENESIS AND METASTASIS USING IMMUNOGLOBULIN CONTAINING AND PROLINE RICH RECEPTOR-1 (IGPR-1) TRUSTEES OF BOSTON UNIVERSITY (US) 2013-01-03 WO disclosed