SCHEMBL14985158

SCHEMBL14985158

COC(=O)CCC(=O)N(CCCCNC(=O)OC(C)(C)C)OC(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.40
CACNA1G O43497 3/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SIGMAR1 Q99720 2/20 0.39
TPSAB1 Q15661 1/20 0.38
TPSD1 Q9BZJ3 1/20 0.38
TPSG1 Q9NRR2 1/20 0.38
CYP3A4 P08684 1/20 0.38
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
IDO1 P14902 1/20 0.38

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
SCHEMBL21023138 0.84 L3MBTL1 (0.50) SIGMAR1CYP3A4NPSR1IDO1
SCHEMBL14985092 0.81 DRD2 (0.39) DRD2TDP1SIGMAR1CYP3A4CKS1B
SCHEMBL14974018 0.80 CKS1B (0.40) DRD2TDP1SIGMAR1CYP3A4CKS1B
SCHEMBL14974020 0.80 CKS1B (0.40) DRD2TDP1SIGMAR1CYP3A4CKS1B
SCHEMBL14985020 0.80 DRD2 (0.40) DRD2CACNA1GTDP1CYP3A4CKS1B
SCHEMBL14985081 0.80 DRD2 (0.40) DRD2CACNA1GTDP1CYP3A4CKS1B
SCHEMBL14985103 0.80 DRD2 (0.40) DRD2CACNA1GTDP1CYP3A4CKS1B
SCHEMBL14985021 0.80 DRD2 (0.40) DRD2CACNA1GTDP1CYP3A4CKS1B
SCHEMBL14985095 0.79 MAPT (0.40) DRD2TDP1CKS1BSKP1SKP2
SCHEMBL14981897 0.76 HDAC3 (0.40) LMNAMEN1KMT2A

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 2 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-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 DRD2 4512/4885CACNA1G 3503/4885LMNA 641/4885

“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.