SCHEMBL126299

SCHEMBL126299

CCCCN(CCCC)c1cc[c]cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40
AR P10275 2/20 0.38
CNR2 P34972 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
NR1H2 P55055 4/20 0.36
NR1H3 Q13133 4/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 3/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
GFER P55789 1/20 0.33

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
SCHEMBL4719828 0.96 EGFR (0.38) EGFRERBB2ARCNR2CHRM2
SCHEMBL1080080 0.94 EGFR (0.36) EGFRERBB2ARCNR2CHRM2
SCHEMBL9800564 0.92 DNM1 (0.38) EGFRERBB2CNR2
SCHEMBL9800597 0.92 DNM1 (0.38) EGFRERBB2CNR2
SCHEMBL2456296 0.92 ALDH1A1 (0.38) EGFRERBB2ARCNR2CHRM2
SCHEMBL2460601 0.92 DNM1 (0.38) EGFRERBB2CNR2
SCHEMBL6553722 0.89 CRHR1 (0.41) EGFRERBB2ARCNR2KDM4E
SCHEMBL128995 0.86 EGFR (0.37) EGFRERBB2ARCNR2KDM4E
SCHEMBL2459645 0.84 CNR2 (0.42) CNR2KDM4ETDP1
SCHEMBL7153351 0.84 EGFR (0.50) EGFRERBB2ARCNR2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107141391-B Ethylene-polar styrene quasi-random copolymer and preparation method thereof 中国科学院长春应用化学研究所 2020-03-13 CN claimed
EP-3386952-A1 SUBSTITUTED BENZIMIDAZOLIUM, PYRIDO-IMIDAZOLIUM, OR PYRAZINO-IMIDAZOLIUM COMPOUNDS AS CHEMOTHERAPEUTICS The Board of Regents of The University of Texas System (US) 2018-10-17 EP claimed
WO-2017100525-A1 SUBSTITUTED BENZIMIDAZOLIUM, PYRIDO-IMIDAZOLIUM, OR PYRAZINO-IMIDAZOLIUM COMPOUNDS AS CHEMOTHERAPEUTICS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-06-15 WO claimed
CN-103946922-A Photorefractive composite UNIV MUENSTER WILHELMS 2014-07-23 CN claimed
CN-101613321-A The list and the bicyclic pyrrole derivatives that suppress part and advanced glycation end product acceptor interaction TRANSTECH PHARMA INC 2009-12-30 CN claimed
CN-101505751-A 8-hydroxyquinoline compounds and methods thereof WYETH CORP (US) 2009-08-12 CN claimed
CN-1633290-A Mono-and bicyclic pyrrole derivatives inhibiting ligand interaction with higher glycation end product receptors TRANSTECH PHARMA INC (US) 2005-06-29 CN claimed
US-6884815-B1 High affinity small molecule C5a receptor modulators NEUROGEN CORPORATION (US) 2005-04-26 US claimed
EP-1482931-A2 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE Transtech Pharma, Inc. (US) 2004-12-08 EP claimed
US-20040082542-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-04-29 US claimed
WO-2003075921-A2 MONO- AND BICYCLIC AZOLE DERIVATIVES THAT INHIBIT THE INTERACTION OF LIGANDS WITH RAGE TRANSTECH PHARMA, INC. (US) 2003-09-18 WO claimed
EP-0884367-B1 Light-writable data storage media containing cationic diphenylamine dyes BAYER AG (DE) 2003-08-13 EP claimed
US-5952475-A CATIONIC THIADIAZOLEDIPHENYLAMINE DYES FOR USE IN INKJET PRINTING AND IN LIGHT-WRITABLE DATA STORAGE MEDIA AND IN DYE TRANSFER FILMS BAYER AKTIENGESELLSCHAFT (DE) 1999-09-14 US claimed
EP-0884367-A2 Cationic diphenylamine dyestuffs and their anhydrobases BAYER AG (DE) 1998-12-16 EP claimed
US-4454211-A Electrophotographic photosensitive member with pyrazoline charge transport material CANON KABUSHIKI KAISHA (JP) 1984-06-12 US claimed
US-4420548-A Electrophotographic member with hydrazone or ketazine compounds CANON KABUSHIKI KAISHA (JP) 1983-12-13 US claimed
US-20220404729-A1 TONER PARTICLES FOR DEVELOPING ELECTROSTATICALLY CHARGED IMAGE AND TONER COMPOSITION FOR DEVELOPING ELECTROSTATICALLY CHARGED IMAGE TOMOEGAWA CORPORATION (JP) 2022-12-22 US disclosed
CN-110461951-B Composition, dichroic material, light-absorbing anisotropic film, laminate, and image display device 富士胶片株式会社 2022-04-08 CN disclosed
US-4008330-A A P-AMINOPHENYL-THIOUREA NIPPON KAYAKU KABUSHIKI KAISHA (JA) 1977-02-15 US disclosed
US-3936462-A CNS DEPRESSANT, ANALGESIC STERLING DRUG INC. (US) 1976-02-03 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 (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-20040082542-A1 Azole derivatives and fused bicyclic azole derivatives as therapeutic agents AGER, S100A4, S100B EGFR 108/4885ERBB2 209/4885AR 22/4885

“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.