SCHEMBL6693472

SCHEMBL6693472

CCOc1ccc2c(c1)N(C(C)(C)C)C(S[N])S2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ APOBEC3G Q9HC16 1/20 0.33
▸ NQO1 P15559 1/20 0.33
▸ SRC P12931 4/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ ALDH1A1 P00352 3/20 0.30
▸ MAPT P10636 2/20 0.30
▸ HSD17B10 Q99714 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ BRCA1 P38398 1/20 0.30
▸ HBB P68871 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30
▸ SLC22A12 Q96S37 1/20 0.30
▸ PSMB8 P28062 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
SCHEMBL6691234 0.90 HTR2A (0.32) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL6691232 0.87 MEN1 (0.35) MEN1KMT2ANPC1APOBEC3GNQO1
SCHEMBL6691267 0.82 NQO1 (0.34) MEN1KMT2ANPC1APOBEC3GNQO1
SCHEMBL6693788 0.80 MEN1 (0.35) MEN1KMT2ANPC1APOBEC3GNQO1
SCHEMBL212848 0.74 MAOA (0.33) —
SCHEMBL6690892 0.74 NQO1 (0.34) MEN1KMT2ANPC1APOBEC3GNQO1
SCHEMBL6698691 0.72 HTR2A (0.33) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL6697925 0.71 KMT2A (0.37) MEN1KMT2ANPC1APOBEC3GNQO1
SCHEMBL6691038 0.70 TSHR (0.33) MEN1KMT2ANPC1ALDH1A1MAPT
SCHEMBL6694898 0.69 MAPT (0.39) MEN1KMT2AAPOBEC3GALDH1A1MAPT

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 4 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-0890605-A2 Pneumatic tire BRIDGESTONE CORPORATION (JP) 1999-01-13 — — EP disclosed
EP-0869016-A2 Pneumatic radial tires Bridgestone Corporation (JP) 1998-10-07 — — EP disclosed
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