SCHEMBL821903

SCHEMBL821903

CC1C(=O)N(Cc2cccc(CN3C(=O)C(C)C(C)C3=O)c2)C(=O)C1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
MEN1 O00255 2/20 0.48
CMA1 P23946 2/20 0.47
ALDH1A1 P00352 4/20 0.44
TSHR P16473 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ELANE P08246 2/20 0.42
F2 P00734 1/20 0.42
PLG P00747 1/20 0.42
CTSG P08311 1/20 0.42
CTRC Q99895 1/20 0.42
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EP300 Q09472 1/20 0.41
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
MGLL Q99685 1/20 0.39

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
SCHEMBL7923401 0.88 KMT2A (0.42) KMT2AMEN1CMA1ALDH1A1TSHR
SCHEMBL10031595 0.86 KMT2A (0.66) KMT2AMEN1CMA1ALDH1A1TSHR
SCHEMBL9975770 0.86 KMT2A (0.66) KMT2AMEN1CMA1ALDH1A1TSHR
SCHEMBL7936379 0.80 KMT2A (0.48) KMT2AMEN1CMA1ALDH1A1TSHR
SCHEMBL17532466 0.77 ALDH1A1 (0.50) KMT2AMEN1CMA1ALDH1A1TSHR
SCHEMBL7924339 0.77 KMT2A (0.50) KMT2AMEN1CMA1ALDH1A1TSHR
SCHEMBL14086649 0.76 KMT2A (0.57) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL12119582 0.76 ALDH1A1 (0.77) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2
SCHEMBL17532457 0.76 ALDH1A1 (0.77) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2
SCHEMBL12119605 0.73 ALDH1A1 (0.79) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252862-B2 Silane coupling agents for filled rubbers BASF SE (DE) 2012-08-28 US disclosed
US-8252862-B2 Silane coupling agents for filled rubbers BASF SE (DE) 2012-08-28 US disclosed
US-8119710-B2 Filled rubber compounds with improved processability BASF SE (DE) 2012-02-21 US disclosed
US-8119710-B2 Filled rubber compounds with improved processability BASF SE (DE) 2012-02-21 US disclosed
EP-2190912-B1 SILANE COUPLING AGENTS FOR FILLED RUBBERS BASF SE (DE) 2011-11-23 EP disclosed
US-20100317778-A1 Filled Rubber Compounds with Improved Processability CIBA CORPORATION 2010-12-16 US disclosed
US-20100317778-A1 Filled Rubber Compounds with Improved Processability CIBA CORPORATION 2010-12-16 US disclosed
US-20100261826-A1 SILANE COUPLING AGENTS FOR FILLED RUBBERS BASF SE (DE) 2010-10-14 US disclosed
US-20100261826-A1 SILANE COUPLING AGENTS FOR FILLED RUBBERS BASF SE (DE) 2010-10-14 US disclosed
US-7723409-B2 Coupling agents between filler and elastomer CIBA SPECIALTY CHEM. CORP. (US) 2010-05-25 US disclosed
US-7723409-B2 Coupling agents between filler and elastomer CIBA SPECIALTY CHEM. CORP. (US) 2010-05-25 US disclosed
WO-2010006889-A2 COUPLING AGENTS FOR FILLED RUBBERS BASF SE (DE) 2010-01-21 WO disclosed
EP-1727858-B1 COUPLING AGENTS BETWEEN FILLER AND ELASTOMER BASF SE (DE) 2009-09-16 EP disclosed
WO-2009034016-A1 SILANE COUPLING AGENTS FOR FILLED RUBBERS BASF SE (CH) 2009-03-19 WO disclosed
US-20080287578-A1 Coupling Agents Between Filler and Elastomer CIBA SPECIALTY CHEMICALS CORP. 2008-11-20 US disclosed
US-20080287578-A1 Coupling Agents Between Filler and Elastomer CIBA SPECIALTY CHEMICALS CORP. 2008-11-20 US disclosed
WO-2007039416-A1 FILLED RUBBER COMPOUNDS WITH IMPROVED PROCESSABILITY CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-04-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100317778-A1 Filled Rubber Compounds with Improved Processability RER1, RIF1, REV1 KMT2A 2949/4885MEN1 1869/4885CMA1 355/4885
US-20100261826-A1 SILANE COUPLING AGENTS FOR FILLED RUBBERS RER1, REV1, RIOX2 KMT2A 1874/4885MEN1 3889/4885CMA1 1019/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.