SCHEMBL6689398

SCHEMBL6689398

CCOc1cccc2c1SC(SN)N2C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.34
▸ MAPT P10636 5/20 0.32
▸ HTT P42858 2/20 0.32
▸ CACNA2D1 P54289 1/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ PKM P14618 2/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ DRD2 P14416 2/20 0.30
▸ DRD4 P21917 2/20 0.30
▸ DRD3 P35462 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ GRK6 P43250 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
SCHEMBL6697903 0.89 CYP1A2 (0.38) ALDH1A1MAPTHTTHTR2BHSD17B10
SCHEMBL6691559 0.87 ALDH1A1 (0.34) ALDH1A1MAPTHTTCACNA2D1PKM
SCHEMBL6696724 0.82 ALDH1A1 (0.35) ALDH1A1MAPTHTTCACNA2D1PKM
SCHEMBL6693679 0.80 ALDH1A1 (0.33) ALDH1A1MAPTHTTHTR2AHTR2C
SCHEMBL6690278 0.77 CYP1A2 (0.35) TSHRDRD2DRD3KMT2A
SCHEMBL6694243 0.76 HRH3 (0.35) ALDH1A1MAPTHTTCACNA2D1HSD17B10
SCHEMBL6690997 0.72 MGLL (0.33) —
SCHEMBL6693788 0.72 MEN1 (0.35) ALDH1A1MAPTHSD17B10TSHRKDM4E
SCHEMBL6691232 0.72 MEN1 (0.35) ALDH1A1MAPTHSD17B10TSHRKDM4E
SCHEMBL6694321 0.71 CYP1A2 (0.39) ALDH1A1MAPTHTTHTR2BHSD17B10

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-0869016-B1 Pneumatic radial tires BRIDGESTONE CORP (JP) 2004-03-03 — — EP disclosed
US-6336486-B1 Pneumatic radical tire having cap base tread BRIDGESTONE CORPORATION (JP) 2002-01-08 — — US disclosed
EP-0869016-A2 Pneumatic radial tires Bridgestone Corporation (JP) 1998-10-07 — — EP disclosed
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