SCHEMBL13667384

SCHEMBL13667384

CC(C)C(=O)Nc1nccc2[nH]cnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.44
CCNE1 P24864 2/20 0.41
CDK2 P24941 2/20 0.41
PARP1 P09874 1/20 0.38
NOS1 P29475 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TP53 P04637 2/20 0.36
ALDH1A1 P00352 2/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
ADORA1 P30542 1/20 0.35
KDR P35968 1/20 0.35
MAPT P10636 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
TYK2 P29597 1/20 0.34
MDM4 O15151 1/20 0.34

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
SCHEMBL17776527 0.83 EGLN1 (0.50) EGLN1CCNE1CDK2PARP1KDM4E
SCHEMBL17778680 0.79 EGLN1 (0.47) EGLN1CCNE1CDK2PARP1KDM4E
SCHEMBL13667390 0.76 ATR (0.42) EGLN1CCNE1CDK2PARP1MAPT
SCHEMBL19699540 0.76 GSK3B (0.38) CCNE1CDK2NOS1SMN1; SMN2KDM4E
SCHEMBL11023230 0.75 BRD4 (0.52) EGLN1NPC1RAB9AKDRTYK2
SCHEMBL19706509 0.74 EGLN1 (0.45) EGLN1CCNE1CDK2PARP1SMN1; SMN2
SCHEMBL19699479 0.74 NOS1 (0.40) CCNE1CDK2NOS1SMN1; SMN2KDM4E
SCHEMBL13667383 0.73 BRD4 (0.57) SMN1; SMN2TP53ALDH1A1NPC1RAB9A
SCHEMBL3133619 0.71 EGLN1 (0.42) EGLN1CCNE1CDK2PARP1SMN1; SMN2
SCHEMBL13667388 0.71 EGLN1 (0.41) EGLN1CCNE1CDK2PARP1ALDH1A1

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
US-20190048016-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2019-02-14 US disclosed
US-20170362234-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-21 US disclosed
US-20170362234-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-21 US disclosed
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 US disclosed
US-20090270431-A1 Cyclopentenol Nucleoside Compounds Intermediates for their Synthesis and Methods of Treating Viral Infections THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION (US) 2009-10-29 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 (4 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-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 EGLN1 531/4885CCNE1 1916/4885CDK2 682/4885
US-20090270431-A1 Cyclopentenol Nucleoside Compounds Intermediates for their Synthesis and Methods of Treating Viral Infections REV1, NSUN2, ORC3 EGLN1 3430/4885CCNE1 503/4885CDK2 539/4885
US-20190048016-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 EGLN1 567/4885CCNE1 1954/4885CDK2 647/4885
US-20170362234-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 EGLN1 567/4885CCNE1 1954/4885CDK2 647/4885

“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.