SCHEMBL14981968

SCHEMBL14981968

COC(=O)/C=C/C(=O)N(O)CCCCN

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
KDM4A O75164 2/20 0.40
KDM6B O15054 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40
HIF1A Q16665 1/20 0.38
TET2 Q6N021 1/20 0.38
DOHH Q9BU89 1/20 0.38
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GFPT1 Q06210 1/20 0.34
CHRM2 P08172 1/20 0.31
PAOX Q6QHF9 2/20 0.31

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
SCHEMBL14981966 0.98 HCAR2 (0.42) HCAR2KEAP1NFE2L2KDM4AKDM6B
SCHEMBL14981965 0.95 HCAR2 (0.45) HCAR2KEAP1NFE2L2KDM4AKDM6B
SCHEMBL14981964 0.79 KDM4A (0.54) KDM4AKDM6BKDM2AHIF1ATET2
SCHEMBL14981960 0.78 KDM4A (0.54) KDM4AKDM6BKDM2AKDM4E
SCHEMBL14981962 0.77 KDM4A (0.52) KDM4AKDM6BKDM2AHIF1ATET2
SCHEMBL14985162 0.75 KDM6B (0.77) KDM4AKDM6BKDM2AKDM4ECHRM2
SCHEMBL17070792 0.74 HCAR2 (0.54) HCAR2KEAP1NFE2L2KDM4ESMN1; SMN2
SCHEMBL13296119 0.72 HCAR2 (0.50) HCAR2KEAP1NFE2L2KDM4ELMNA
SCHEMBL14985134 0.71 KDM6B (0.62) KDM4AKDM6BKDM2AKDM4ESMN1; SMN2
SCHEMBL3463701 0.69 HCAR2 (0.46) HCAR2KEAP1NFE2L2LMNAGFPT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735622-B2 Histone demethylase inhibitors and methods for using the same THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2014-05-27 US disclosed
US-8735622-B2 Histone demethylase inhibitors and methods for using the same THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2014-05-27 US disclosed
US-20130137720-A1 HISTONE DEMETHYLASE INHIBITORS AND METHODS FOR USING THE SAME The Regents of the University of Colorado, a body corporated (US) 2013-05-30 US disclosed
US-20130137720-A1 HISTONE DEMETHYLASE INHIBITORS AND METHODS FOR USING THE SAME The Regents of the University of Colorado, a body corporated (US) 2013-05-30 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-20130137720-A1 HISTONE DEMETHYLASE INHIBITORS AND METHODS FOR USING THE SAME KDM1A, KDM3A, KDM7A HCAR2 695/4885KEAP1 779/4885NFE2L2 2166/4885

“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.