SCHEMBL1200862

SCHEMBL1200862

NC(N)OC(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.63
TP53 P04637 1/20 0.63
LMNA P02545 3/20 0.56
F2 P00734 1/20 0.56
ALDH1A1 P00352 4/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.50
POLB P06746 2/20 0.50
PDCD1 Q15116 1/20 0.50
CD274 Q9NZQ7 1/20 0.50
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
TDP1 Q9NUW8 3/20 0.47
CYP3A4 P08684 1/20 0.46
PARP1 P09874 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL601643 0.83 TSHR (0.59) TSHRTP53LMNAF2ALDH1A1
SCHEMBL23777037 0.83 TSHR (0.59) TSHRTP53LMNAF2ALDH1A1
SCHEMBL12977332 0.81 TSHR (0.57) TSHRTP53LMNAF2ALDH1A1
SCHEMBL27926613 0.81 TSHR (0.57) TSHRTP53LMNAF2ALDH1A1
SCHEMBL11474021 0.81 TSHR (0.57) TSHRTP53LMNAF2ALDH1A1
SCHEMBL4445835 0.81 TSHR (0.57) TSHRTP53LMNAF2ALDH1A1
SCHEMBL9615408 0.79 TSHR (0.55) TSHRTP53LMNAF2ALDH1A1
SCHEMBL28024698 0.79 TSHR (0.55) TSHRTP53LMNAF2ALDH1A1
SCHEMBL27926927 0.79 TSHR (0.55) TSHRTP53LMNAF2ALDH1A1
SCHEMBL11505949 0.79 TSHR (0.55) TSHRTP53LMNAF2ALDH1A1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109804306-A Light orientation copolymer material 罗利克技术有限公司 2019-05-24 CN disclosed
CN-108350174-A Photo-alignment material 罗利克技术有限公司 2018-07-31 CN disclosed
CN-108350363-A Can photo-alignment material composition 罗利克技术有限公司 2018-07-31 CN disclosed
CN-105051023-B Stem cell is promoted to be divided into the compound of liver cell 豪夫迈·罗氏有限公司 2017-08-22 CN disclosed
CN-105051023-A Compounds for improved stem cell differentiation into hepatocytes HOFFMANN LA ROCHE 2015-11-11 CN disclosed
US-8946259-B2 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2015-02-03 US disclosed
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2014-03-06 US disclosed
US-8598353-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2013-12-03 US disclosed
EP-1863771-B1 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS HIGH POINT PHARMACEUTICALS LLC (US) 2012-11-07 EP disclosed
CN-101142194-B Benzazole derivatives, compositions, and methods of use as b-secretase inhibitors TRANSTECH PHARMA INC 2012-10-10 CN disclosed
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-03-17 US disclosed
US-7893267-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-02-22 US disclosed
US-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors VTVX HOLDINGS II LLC 2009-12-31 US disclosed
EP-1863771-A2 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS Transtech Pharma, Inc. (US) 2007-12-12 EP disclosed
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC 2006-10-05 US disclosed
WO-2006099379-A2 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS TRANSTECH PHARMA, INC. (US) 2006-09-21 WO disclosed
EP-1196398-A4 BRIDGED FLUORESCENT DYES, THEIR PREPARATION AND THEIR USE IN ASSAYS SURROMED INC (US) 2002-11-06 EP disclosed
US-6403807-B1 CYANINE DYES HAVING SEPARATE SECOND LINKING CHAIN JOINING TWO HETEROCYCLES TO RESTRAIN COMPOUND INTO DESIRED CONFORMATION WHICH ABSORBS ELECTROMAGNETIC ENERGY AND EMITS FLUORESCENCE AT SPECIFIED WAVELENGTHS SURROMED, INC. 2002-06-11 US disclosed
EP-1196398-A1 BRIDGED FLUORESCENT DYES, THEIR PREPARATION AND THEIR USE IN ASSAYS Surromed, Inc. (US) 2002-04-17 EP disclosed
WO-2001002374-A1 BRIDGED FLUORESCENT DYES, THEIR PREPARATION AND THEIR USE IN ASSAYS SURROMED, INC. (US) 2001-01-11 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 (4 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-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP TSHR 4866/4885TP53 2464/4885LMNA 679/4885
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors BACE1, BACE2, APP TSHR 4862/4885TP53 2358/4885LMNA 457/4885
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors BACE1, BACE2, APP TSHR 4866/4885TP53 2464/4885LMNA 679/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP TSHR 4866/4885TP53 2464/4885LMNA 679/4885

“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.