SCHEMBL6697188

SCHEMBL6697188

CCOc1ccc2c(c1)SC(S[N])N2C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ NQO1 P15559 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ APOBEC3G Q9HC16 1/20 0.33
▸ ALDH1A1 P00352 6/20 0.32
▸ MAPT P10636 4/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ SRC P12931 4/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ HSD17B10 Q99714 3/20 0.31
▸ TP53 P04637 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ BRCA1 P38398 1/20 0.31
▸ HBB P68871 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ SLC22A12 Q96S37 1/20 0.31

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
SCHEMBL6693472 0.91 MEN1 (0.33) KMT2AMEN1NQO1NPC1APOBEC3G
SCHEMBL6693788 0.88 MEN1 (0.35) KMT2AMEN1NQO1NPC1APOBEC3G
SCHEMBL6690892 0.83 NQO1 (0.34) KMT2AMEN1NQO1NPC1APOBEC3G
SCHEMBL6691234 0.81 HTR2A (0.32) KMT2AMEN1NPC1ALDH1A1MAPT
SCHEMBL6691038 0.79 TSHR (0.33) KMT2AMEN1NPC1ALDH1A1MAPT
SCHEMBL6691232 0.78 MEN1 (0.35) KMT2AMEN1NQO1NPC1APOBEC3G
SCHEMBL6693776 0.77 SMN1; SMN2 (0.38) KMT2AMEN1NPC1ALDH1A1MAPT
SCHEMBL6691267 0.75 NQO1 (0.34) KMT2AMEN1NQO1NPC1APOBEC3G
SCHEMBL6692273 0.73 SNCA (0.40) KMT2AMEN1NPC1ALDH1A1MAPT
SCHEMBL212848 0.72 MAOA (0.33) CYP3A4

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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