SCHEMBL348241

SCHEMBL348241

Oc1ccc(-c2cccc3c2[nH]c2ccccc23)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 6/20 0.58
CCND1 P24385 6/20 0.58
CCNB2 O95067 1/20 0.54
CCNE2 O96020 1/20 0.54
CDK1 P06493 1/20 0.54
CCNB1 P14635 1/20 0.54
CCNE1 P24864 1/20 0.54
CDK2 P24941 1/20 0.54
CCNB3 Q8WWL7 1/20 0.54
ESR1 P03372 3/20 0.53
ESR2 Q92731 3/20 0.53
PARP14 Q460N5 9/20 0.52
KIF11 P52732 1/20 0.49

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
Phenol SCHEMBL4637697 0.92 CDK4 (0.56) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL29407801 0.91 KIF11 (0.57) CDK4CCND1PARP14KIF11
SCHEMBL1326376 0.91 KIF11 (0.57) CDK4CCND1PARP14KIF11
SCHEMBL208888 0.91 KIF11 (0.57) CDK4CCND1PARP14KIF11
SCHEMBL30641449 0.91 KIF11 (0.57) CDK4CCND1PARP14KIF11
SCHEMBL38828 0.91 KIF11 (0.57) CDK4CCND1PARP14KIF11
SCHEMBL1326378 0.89 KIF11 (0.55) CDK4CCND1PARP14KIF11
SCHEMBL30985273 0.87 CDK4 (0.54) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL866841 0.87 KIF11 (0.53) CDK4CCND1PARP14KIF11
SCHEMBL30985274 0.87 CDK4 (0.54) CDK4CCND1CCNB2CCNE2CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116891585-A Preparation method of soluble polyaryletherketone film with low toxicity solvent 大连中科聚合新材料科技有限公司 2023-10-17 CN claimed
CN-116790006-A Preparation method of polyarylethersulfone film with low toxicity solvent 大连中科聚合新材料科技有限公司 2023-09-22 CN claimed
CN-110655642-B Carbazolyl-containing quaternary phosphonium salt and metalloporphyrin polymer microporous material as well as preparation method and application thereof 海南大学 2022-07-08 CN claimed
CN-110655642-A Carbazolyl-containing quaternary phosphonium salt and metalloporphyrin polymer microporous material and preparation method and application thereof 海南大学 2020-01-07 CN claimed
EP-2448925-B1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORP (JP) 2017-12-06 EP claimed
US-8927121-B2 Emissive aryl-heteroaryl compounds NITTO DENKO CORPORATION (JP) 2015-01-06 US claimed
CN-104016996-A Novel benzopyran photo-chromic derivative SHANGHAI GANTIAN OPTICAL MATERIAL CO LTD 2014-09-03 CN claimed
US-8771845-B2 2014-07-08 US claimed
US-20130284907-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2013-10-31 US claimed
US-20100326526-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS NITTO DENKO CORPORATION (JP) 2010-12-30 US claimed
EP-3609867-B1 CARBAZOLE COMPOUNDS AND METHODS OF USE THEREOF GSNO THERAPEUTICS INC (US) 2024-05-15 EP disclosed
CN-110372540-B 3, 6-di (prop-2-ylidene) cyclohexa-1, 4-diene derivatives, methods of making, uses, and devices 武汉尚赛光电科技有限公司 2022-11-11 CN disclosed
CN-110655642-B Carbazolyl-containing quaternary phosphonium salt and metalloporphyrin polymer microporous material as well as preparation method and application thereof 海南大学 2022-07-08 CN disclosed
CN-111290216-B Hard mask composition, hard mask and method for forming pattern 厦门恒坤新材料科技股份有限公司 2022-05-20 CN disclosed
CN-111240153-B Hard mask composition, hard mask and method for forming pattern 厦门恒坤新材料科技股份有限公司 2022-05-20 CN disclosed
WO-2003091262-A1 BRIDGED BI-AROMATIC LIGANDS, COMPLEXES, CATALYSTS AND PROCESSES FOR POLYMERIZING AND POYMERS THEREFROM SYMYX TECHNOLOGIES, INC. (US) 2003-11-06 WO disclosed
US-6451455-B1 CHARGE CARRIER LAYER COMPRISES A COMPOUND HAVING TWO 2-METHYL-8-QUINOLINOLATO LIGANDS COORDINATED WITH AL AS ELECTRON TRANSPORTING MOIETIES AND ONE TRIARYLAMINE DERIVATIZED PHENOXIDE AS A HOLE TRANSPORTING MOIETY THE TRUSTEES OF PRINCETON UNIVERSITY 2002-09-17 US disclosed
EP-1044586-A4 HIGHLY TRANSPARENT NON-METALLIC CATHODES UNIV PRINCETON (US) 2000-11-08 EP disclosed
EP-1044586-A2 HIGHLY TRANSPARENT NON-METALLIC CATHODES The Trustees of Princeton University (US) 2000-10-18 EP disclosed
WO-1999020081-A2 HIGHLY TRANSPARENT NON-METALLIC CATHODES THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1999-04-22 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 (1 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-20100326526-A1 EMISSIVE ARYL-HETEROARYL COMPOUNDS AHR, AR, ARNT CDK4 489/4885CCND1 1090/4885CCNB2 413/4885

“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.