SCHEMBL64877

SCHEMBL64877

Nc1ccc2c(c1)[nH]c1cc(N)ccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.67
PARP1 P09874 2/20 0.65
CDK4 P11802 1/20 0.61
CCND1 P24385 1/20 0.61
AR P10275 1/20 0.50
IMPDH2 P12268 2/20 0.47
AHR P35869 1/20 0.44
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
RXFP1 Q9HBX9 2/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
PRKCI P41743 1/20 0.41
CYP2A6 P11509 1/20 0.41
KEAP1 Q14145 1/20 0.41
MAPK13 O15264 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
SCHEMBL29683901 1.00 KIF11 (0.67) KIF11PARP1CDK4CCND1AR
SCHEMBL30975189 0.91 KIF11 (0.68) KIF11PARP1CDK4CCND1AR
SCHEMBL5914553 0.91 KIF11 (0.68) KIF11PARP1CDK4CCND1AR
SCHEMBL30235013 0.89 CDK4 (0.79) KIF11PARP1CDK4CCND1AHR
SCHEMBL1181826 0.89 CDK4 (0.79) KIF11PARP1CDK4CCND1AHR
Hydrochloric Acid SCHEMBL6432050 0.87 CDK4 (0.76) KIF11PARP1CDK4CCND1AHR
SCHEMBL12722519 0.87 KIF11 (0.62) KIF11PARP1CDK4CCND1AR
SCHEMBL3885306 0.87 KIF11 (0.55) KIF11PARP1CDK4CCND1AR
Hydrochloric Acid SCHEMBL30404107 0.87 CDK4 (0.76) KIF11PARP1CDK4CCND1AHR
Water SCHEMBL411737 0.87 CDK4 (0.76) KIF11PARP1CDK4CCND1AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030993-B2 Polyimide and method for manufacturing same WUHAN CHINA STAR OPTOELECTRONICS SEMICONDUCTOR DISPLAY TECHNOLOGY CO., LTD. (CN) 2024-07-09 US claimed
CN-117700770-A COF material, COF-based heterostructure catalyst, and preparation method and application thereof 淮安中顺环保科技有限公司 2024-03-15 CN claimed
US-20230174717-A1 POLYIMIDE AND METHOD FOR MANUFACTURING SAME WUHAN CHINA STAR OPTOELECTRONICS SEMICONDUCTOR DISPLAY TECHNOLOGY CO., LTD. (CN) 2023-06-08 US claimed
CN-113150445-B Water-blocking oxygen-blocking polyolefin material and preparation method and application thereof 江苏南方包装有限公司 2022-06-24 CN claimed
CN-113150445-A Water-blocking oxygen-blocking polyolefin material and preparation method and application thereof 江苏南方包装有限公司 2021-07-23 CN claimed
US-20180057527-A1 CARBAZOLE COMPOUND HAVING ANTI-VIRUS ACTIVITY KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2018-03-01 US claimed
CN-103959174-B Alcohol-soluble hole transport materials for organic photoconductor coatings 惠普发展公司,有限责任合伙企业 2017-06-09 CN claimed
EP-2795406-B1 ALCOHOL-SOLUBLE HOLE TRANSPORT MATERIALS FOR ORGANIC PHOTOCONDUCTOR COATINGS HEWLETT PACKARD DEVELOPMENT CO LP (US) 2017-02-08 EP claimed
US-9482970-B2 Organic photoconductors having protective coatings with nanoparticles HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2016-11-01 US claimed
EP-2831674-B1 ORGANIC PHOTOCONDUCTORS HAVING PROTECTIVE COATINGS WITH NANOPARTICLES HEWLETT PACKARD DEVELOPMENT CO (US) 2016-03-30 EP claimed
EP-2831674-A1 ORGANIC PHOTOCONDUCTORS HAVING PROTECTIVE COATINGS WITH NANOPARTICLES Hewlett-Packard Development Company, L.P. (US) 2015-02-04 EP claimed
US-20140349227-A1 ORGANIC PHOTOCONDUCTORS HAVING PROTECTIVE COATINGS WITH NANOPARTICLES HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2014-11-27 US claimed
US-20140322638-A1 ALCOHOL-SOLUBLE HOLE TRANSPORT MATERIALS FOR ORGANIC PHOTOCONDUCTOR COATINGS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2014-10-30 US claimed
EP-2795406-A1 ALCOHOL-SOLUBLE HOLE TRANSPORT MATERIALS FOR ORGANIC PHOTOCONDUCTOR COATINGS Hewlett-Packard Development Company, L.P. (US) 2014-10-29 EP claimed
WO-2013147864-A1 ORGANIC PHOTOCONDUCTORS HAVING PROTECTIVE COATINGS WITH NANOPARTICLES HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2013-10-03 WO claimed
WO-2013095398-A1 ALCOHOL-SOLUBLE HOLE TRANSPORT MATERIALS FOR ORGANIC PHOTOCONDUCTOR COATINGS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2013-06-27 WO claimed
US-20080098535-A1 Keratin Dyeing Compounds, Keratin Dyeing Compositions Containing Them, And Use Thereof GLENN ROBERT W JR 2008-05-01 US claimed
CN-100343740-C Aligning agent for liquid crystal and liquid-crystal display element NISSAN CHEMICAL IND LTD (JP) 2007-10-17 CN claimed
US-20050217038-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-10-06 US claimed
EP-0330456-B1 Preparation of silicon-containing polyimide precursor and cured polyimides obtained therefrom CHISSO CORP (JP) 1994-09-07 EP claimed

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

For each of this compound's patents that has machine-readable text (3 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-20050217038-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, CKMT1A; CKMT1B, TUBB6 KIF11 779/4885PARP1 2050/4885CDK4 694/4885
US-20180057527-A1 CARBAZOLE COMPOUND HAVING ANTI-VIRUS ACTIVITY ZC3HAV1, ZC3HAV1L, GTF3C3 KIF11 1282/4885PARP1 3187/4885CDK4 145/4885
US-20080098535-A1 Keratin Dyeing Compounds, Keratin Dyeing Compositions Containing Them, And Use Thereof KRT18, CKMT1A; CKMT1B, TUBB6 KIF11 779/4885PARP1 2050/4885CDK4 694/4885

“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.