SCHEMBL7905020

SCHEMBL7905020

O=C1C=CC=C2c3ccccc3SC12

nearest known ligand 0.31

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
IDO1 P14902 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
CDC25B P30305 1/20 0.30
AKT1 P31749 1/20 0.30
SNCA P37840 1/20 0.30
MAP2K1 Q02750 1/20 0.30
PIN1 Q13526 1/20 0.30
EHMT2 Q96KQ7 1/20 0.30
NSD1 Q96L73 1/20 0.30
EHMT1 Q9H9B1 1/20 0.30
SLC2A1 P11166 1/20 0.30

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
SCHEMBL6712909 0.90 TTK (0.33) MAPTHPGDTSHRMAPK1SMN1; SMN2
SCHEMBL4324158 0.67 TTK (0.35)
SCHEMBL6688204 0.66 MAPT (0.45) MAPTHPGDMAPK1SMN1; SMN2MAOA
SCHEMBL24541282 0.64 BCHE (0.31)
SCHEMBL6407540 0.64 TTK (0.30)
SCHEMBL14230550 0.63 TTK (0.33) MAPTHPGDTSHRMAPK1MAOB
SCHEMBL3274379 0.63 MAPT (0.42) MAPTHPGDTSHRMAPK1SMN1; SMN2
SCHEMBL2233981 0.63 TSHR (0.37) HPGDTSHRMAPK1SMN1; SMN2MAOA
SCHEMBL4619988 0.62 CYP19A1 (0.37) MAPTTSHRMAPK1MAOB
SCHEMBL5969253 0.62 MAPT (0.41) MAPTHPGDTSHRMAPK1SMN1; SMN2

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-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed