SCHEMBL5378136

SCHEMBL5378136

Cc1cc(C)c2c(c1)NC(=O)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
MMP12 P39900 1/20 0.40
GSK3B P49841 4/20 0.39
CCNB2 O95067 3/20 0.39
CDK1 P06493 3/20 0.39
CCNB1 P14635 3/20 0.39
CDK5 Q00535 3/20 0.39
CDK5R1 Q15078 3/20 0.39
CCNB3 Q8WWL7 3/20 0.39
GRIA1 P42261 2/20 0.39
CACNG8 Q8WXS5 2/20 0.39
AHR P35869 4/20 0.39
CMA1 P23946 2/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL12992123 0.81 GRIA1 (0.41) CA9GSK3BCCNB2CDK1CCNB1
SCHEMBL25746058 0.81 GSK3B (0.38) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL10130338 0.81 AHR (0.44) MMP12GSK3BCCNB2CDK1CCNB1
SCHEMBL5246021 0.81 CMA1 (0.41) MMP12GSK3BCCNB2CDK1CCNB1
SCHEMBL5789814 0.81 GSK3B (0.38) CA9MMP12GSK3BCCNB2CDK1
SCHEMBL31383739 0.81 CMA1 (0.41) MMP12GSK3BCCNB2CDK1CCNB1
SCHEMBL9834730 0.78 GSK3B (0.42) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL10129810 0.77 POLB (0.37) MMP12GSK3BCCNB2CDK1CCNB1
SCHEMBL5789641 0.75 GPR35 (0.44) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL10714014 0.75 GRIA1 (0.49) GSK3BCCNB2CDK1CCNB1CDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180256543-A1 SUBSTITUTED 5-HYDROXYOXINDOLES AND THEIR USE AS ANALGESICS AND FEVER REDUCERS CARAFE DRUG INNOVATION, LLC. 2018-09-13 US disclosed
WO-2016179157-A1 SUBSTITUTED 5-HYDROXYOXINDOLES AND THEIR USE AS ANALGESICS AND FEVER REDUCERS CARAFE DRUG INNOVATION, LLC (US) 2016-11-10 WO disclosed
WO-2016179157-A1 SUBSTITUTED 5-HYDROXYOXINDOLES AND THEIR USE AS ANALGESICS AND FEVER REDUCERS CARAFE DRUG INNOVATION, LLC (US) 2016-11-10 WO disclosed
EP-1955697-B1 2-AMINOBENZAMIDE DERIVATIVES AS VANILLOID RECEPTOR 1 (VR1) INHIBITORS USEFUL FOR THE TREATMENT OF PAIN OR BLADDER FUNCTION DISORDER ASTELLAS PHARMA INC (JP) 2012-05-02 EP disclosed
US-8106190-B2 2-aminobenzamide derivatives ASTELLAS PHARMA INC. (JP) 2012-01-31 US disclosed
US-8106190-B2 2-aminobenzamide derivatives ASTELLAS PHARMA INC. (JP) 2012-01-31 US disclosed
US-20090233900-A1 2-AMINOBENZAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-09-17 US disclosed
US-20090233900-A1 2-AMINOBENZAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-09-17 US disclosed
EP-1955697-A1 2-AMINOBENZAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2008-08-13 EP disclosed
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-7189721-B2 Bicyclic protein kinase inhibitors SUGEN INC. (US) 2007-03-13 US disclosed
US-7189721-B2 Bicyclic protein kinase inhibitors SUGEN INC. (US) 2007-03-13 US disclosed
US-7189721-B2 Bicyclic protein kinase inhibitors SUGEN INC. (US) 2007-03-13 US disclosed
US-6906093-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2005-06-14 US disclosed
US-6683082-B2 3-HETERO-ARYLIDENE-2-INDOLINONE COMPOUNDS; ANTICANCER AGENTS SUGEN, INC. 2004-01-27 US disclosed
US-6486185-B1 3-heteroarylidene-2-indolinone protein kinase inhibitors SUGEN, INC. 2002-11-26 US disclosed
US-6316429-B1 ENZYME INHIBITORS MODULATE THE ACTIVITY OF PROTEIN KINASES AND THEREFORE ARE EXPECTED TO BE USEFUL IN THE PREVENTION AND TREATMENT OF PROTEIN KINASE RELATED CELLULAR DISORDERS SUCH AS CANCER. SUGEN, INC. 2001-11-13 US 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-20090233900-A1 2-AMINOBENZAMIDE DERIVATIVE TRPV1, TRPV2, TRPV5 CA12 3007/4885CA1 2067/4885CA2 267/4885
US-20180256543-A1 SUBSTITUTED 5-HYDROXYOXINDOLES AND THEIR USE AS ANALGESICS AND FEVER REDUCERS NPY5R, NPY1R, MC5R CA12 3567/4885CA1 1323/4885CA2 1415/4885

“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.