SCHEMBL18933404

SCHEMBL18933404

CC(C)c1[nH]c(=O)[nH]c(=O)c1C(C)C

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
TYMP P19971 1/20 0.33
GDA Q9Y2T3 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CA12 O43570 1/20 0.31
PARP1 P09874 1/20 0.31
CA9 Q16790 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 2/20 0.30

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
SCHEMBL269470 0.79 HCAR2 (0.32) HCAR2PDE3BPDE3ATYMPCYP1A2
SCHEMBL25131987 0.78 PDE3B (0.35) PDE3BPDE3A
SCHEMBL10238804 0.76 PDE3B (0.42) HCAR2PDE3BPDE3ATYMPGDA
SCHEMBL7674378 0.76 LMNA (0.44) TYMPKDM4ECA12PARP1CA9
SCHEMBL9016367 0.74 TYMP (0.31) TYMP
SCHEMBL10127313 0.74 NPC1 (0.44) HCAR2PDE3BPDE3AKDM4ENPC1
SCHEMBL1484455 0.74 TYMP (0.45) TYMPNPC1RAB9A
SCHEMBL20886374 0.71 KDM4E (0.37) HCAR2PDE3BPDE3ATYMPKDM4E
SCHEMBL14309702 0.70 DAO (0.38)
SCHEMBL13360253 0.70 LMNA (0.35) TYMPKDM4ENPC1RAB9ALMNA

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-10954251-B2 Thienopyrimidine inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-03-23 US disclosed
US-20190106433-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C WINDTREE THERAPEUTICS, INC. 2019-04-11 US disclosed
US-10183950-B2 Thienopyrimidine inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-01-22 US disclosed
US-20170166558-A1 O-GLCNAC TRANSFERASE (OGT) INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-06-15 US disclosed
US-20170158706-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2017-06-08 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 (5 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-20170166558-A1 O-GLCNAC TRANSFERASE (OGT) INHIBITORS AND USES THEREOF OGA, OGT, CSGALNACT1 HCAR2 3949/4885PDE3B 4075/4885PDE3A 4419/4885
US-10183950-B2 Thienopyrimidine inhibitors of atypical protein kinase C PRKCQ, PRKDC, PRKACA HCAR2 4640/4885PDE3B 1746/4885PDE3A 2148/4885
US-20190106433-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C PRKX, PRKCQ, PRKACA HCAR2 4503/4885PDE3B 1084/4885PDE3A 1261/4885
US-10954251-B2 Thienopyrimidine inhibitors of atypical protein kinase C PRKX, PRKCQ, PRKACA HCAR2 4503/4885PDE3B 1084/4885PDE3A 1261/4885
US-20170158706-A1 THIENOPYRIMIDINE INHIBITORS OF ATYPICAL PROTEIN KINASE C PRKCQ, PRKDC, PRKACA HCAR2 4640/4885PDE3B 1746/4885PDE3A 2148/4885

“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.