SCHEMBL13656876

SCHEMBL13656876

O=C(Nc1ccc(Sc2ccccc2)c2c1C(=O)c1ccccc1C2=O)c1ccccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 1/20 0.52
▸ CYP1A2 P05177 2/20 0.48
▸ HPGD P15428 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ RAB9A P51151 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ MMP14 P50281 1/20 0.45
▸ ADORA2A P29274 1/20 0.42
▸ TSHR P16473 1/20 0.41

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
SCHEMBL14086603 0.88 CYP1A2 (0.49) CYP1A2ALDH1A1LMNAMAPTMEN1
SCHEMBL14030998 0.87 LMNA (0.47) CYP1A2HPGDRAB9AALDH1A1LMNA
SCHEMBL6421532 0.86 CASP3 (0.65) CASP3CYP1A2HPGDCYP2C19RAB9A
SCHEMBL11533939 0.84 MEN1 (0.64) CASP3CYP1A2HPGDALDH1A1MAPT
SCHEMBL13660406 0.84 MEN1 (0.54) CYP1A2HPGDRAB9AALDH1A1LMNA
SCHEMBL14030968 0.83 MAOA (0.57) CASP3HPGDCYP2C19RAB9AALDH1A1
SCHEMBL13656878 0.81 MEN1 (0.51) CASP3CYP1A2HPGDCYP2C19RAB9A
SCHEMBL14030963 0.80 MEN1 (0.58) CASP3CYP1A2HPGDALDH1A1LMNA
SCHEMBL10728362 0.79 KMT2A (0.67) CASP3CYP1A2HPGDCYP2C19RAB9A
SCHEMBL13656877 0.79 L3MBTL1 (0.64) CASP3CYP1A2HPGDRAB9AALDH1A1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608117-B2 Method for producing a granular formulation of plastic-soluble colorants CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-10-27 — — US disclosed
US-7608117-B2 Method for producing a granular formulation of plastic-soluble colorants CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-10-27 — — US disclosed
EP-1438357-B1 A METHOD FOR PRODUCING A GRANULAR FORMULATION OF PLASTIC-SOLUBLE COLORANTS CIBA HOLDING INC (CH) 2009-05-06 — — EP disclosed
US-7435270-B2 Pigment/dye mixtures HUNTSMAN INTERNATIONAL LLC (US) 2008-10-14 — — US disclosed
US-7435270-B2 Pigment/dye mixtures HUNTSMAN INTERNATIONAL LLC (US) 2008-10-14 — — US disclosed
US-20080153943-A1 Method for producing a granular formulation of plastic-soluble colorants CIBA SPECIALTY CHEMICALS CORP. 2008-06-26 — — US disclosed
US-20080153943-A1 Method for producing a granular formulation of plastic-soluble colorants CIBA SPECIALTY CHEMICALS CORP. 2008-06-26 — — US disclosed
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