SCHEMBL9975277

SCHEMBL9975277

CC(C)=NOCCN1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSMB1 P20618 11/20 0.41
PSMB5 P28074 11/20 0.41
PSMB2 P49721 9/20 0.39
LMNA P02545 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
NPC1 O15118 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL13151498 1.00 PSMB1 (0.41) PSMB1PSMB5PSMB2LMNAHRH3
Hydrochloric Acid SCHEMBL28035282 0.98 PSMB1 (0.41) PSMB1PSMB5PSMB2LMNAHRH3
SCHEMBL6978681 0.98 PSMB1 (0.39) PSMB1PSMB5PSMB2LMNANPC1
SCHEMBL14667509 0.89 HRH3 (0.45) HRH3KDM4EPOLBMAPT
SCHEMBL6976253 0.84 PAOX (0.39) HRH3NPC1KDM4EALDH1A1
SCHEMBL9945570 0.83 PSMB1 (0.40) PSMB1PSMB5PSMB2LMNANPC1
SCHEMBL9944262 0.83 PSMB1 (0.43) PSMB1PSMB5PSMB2LMNAHRH3
SCHEMBL6957764 0.82 PSMB1 (0.40) PSMB1PSMB5PSMB2LMNAHRH3
SCHEMBL6977002 0.81 ALDH1A1 (0.42) HRH3KDM4EALDH1A1POLB
SCHEMBL6976865 0.81 PSMB1 (0.36) PSMB1PSMB5PSMB2LMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103819360-B A kind of amine alcoxyl amido replaces curcumin chemical compounds and its preparation method and application HUZHOU TEACHERS COLLEGE (CN) 2015-10-28 CN disclosed
US-8772290-B2 Alpha-arylmethoxyacrylate derivative, preparation method thereof, and pharmaceutical composition containing same Oscotech Inc. (KR) 2014-07-08 US disclosed
US-8202879-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-06-19 US disclosed
US-20100249082-A1 MODULATORS OF HYPOXIA INDUCIBLE FACTOR-1 AND RELATED USES Bionaut Pharmaceuticals INC. (US) 2010-09-30 US disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 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-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity ERBB2, EGFR, ABL1 PSMB1 2822/4885PSMB5 2481/4885PSMB2 2104/4885
US-20100249082-A1 MODULATORS OF HYPOXIA INDUCIBLE FACTOR-1 AND RELATED USES HIF1AN, HIF1A, HYOU1 PSMB1 3307/4885PSMB5 3910/4885PSMB2 3504/4885

“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.