SCHEMBL6693679

SCHEMBL6693679

CCOc1cccc2c1N(C(C)(C)C)C(SN)S2

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 3/20 0.32
▸ HTT P42858 1/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ PKM P14618 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
▸ POLB P06746 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
SCHEMBL6689075 0.90 HTR2C (0.34) ALDH1A1MAPTHTTHTR2CHTR2B
SCHEMBL6697971 0.89 CYP1A2 (0.38) ALDH1A1MAPTHTTHTR2BKDM4E
SCHEMBL6692263 0.82 ALDH1A1 (0.35) ALDH1A1MAPTHTTHTR2AHTR2C
SCHEMBL6690623 0.80 CRHBP (0.34) —
SCHEMBL7046999 0.80 ALDH1A1 (0.34) ALDH1A1MAPTHTTHTR2AHTR2C
SCHEMBL6689398 0.80 ALDH1A1 (0.34) ALDH1A1MAPTHTTHTR2AHTR2C
SCHEMBL6689034 0.78 HTR2C (0.32) HTR2CHTR2B
SCHEMBL6689067 0.76 HRH3 (0.35) ALDH1A1MAPTHTTHTR2AHTR2C
SCHEMBL6693788 0.72 MEN1 (0.35) ALDH1A1MAPTKDM4EMEN1MAPK1
SCHEMBL6691232 0.72 MEN1 (0.35) ALDH1A1MAPTKDM4EMEN1MAPK1

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
Send feedback