SCHEMBL6693802

SCHEMBL6693802

COc1ccc2c(c1)SC(S[N])N2C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 7/20 0.38
▸ LMNA P02545 2/20 0.37
▸ CACNA1S Q13698 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ NOTUM Q6P988 1/20 0.34
▸ GSTP1 P09211 1/20 0.33
▸ PKM P14618 1/20 0.32
▸ HSD17B3 P37058 1/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ NOX1 Q9Y5S8 1/20 0.31
▸ NPC1 O15118 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
SCHEMBL6697218 0.90 CYP1A2 (0.32) SNCALMNAKDM4EALDH1A1NOTUM
SCHEMBL6692273 0.87 SNCA (0.40) SNCALMNACACNA1SKDM4EALDH1A1
SCHEMBL6697188 0.85 KMT2A (0.33) KDM4EALDH1A1MEN1MAPTMAPK1
SCHEMBL6691556 0.79 SNCA (0.37) SNCALMNACACNA1SKDM4EALDH1A1
SCHEMBL6696740 0.76 SNCA (0.34) SNCALMNAKDM4EALDH1A1MEN1
SCHEMBL6693472 0.76 MEN1 (0.33) KDM4EALDH1A1MEN1MAPTMAPK1
SCHEMBL6693170 0.75 MPI (0.38) SNCALMNAKDM4EALDH1A1CYP1A2
SCHEMBL6693788 0.73 MEN1 (0.35) LMNAKDM4EALDH1A1MEN1MAPT
SCHEMBL6691038 0.71 TSHR (0.33) LMNAALDH1A1MEN1GAAMAPT
SCHEMBL6694898 0.70 MAPT (0.39) SNCALMNAKDM4EALDH1A1MEN1

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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