SCHEMBL6380548

SCHEMBL6380548

COC(=O)c1[c]c(OC)c(OC)c(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
POLB P06746 2/20 0.46
HSD17B10 Q99714 2/20 0.43
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
CYP3A4 P08684 2/20 0.38
MAPT P10636 2/20 0.38
TPMT P51580 1/20 0.38
ALDH1A1 P00352 5/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HPGD P15428 3/20 0.37
HTR1A P08908 1/20 0.37
HTR2C P28335 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
GFER P55789 1/20 0.36
MCL1 Q07820 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
SCHEMBL744322 0.71 ACHE (0.44) KDM4EGAAHTTCYP3A4MAPT
SCHEMBL4595713 0.70 ACHE (0.48) KDM4EGAAHTTCYP3A4MAPT
Methyl Syringate SCHEMBL211747 0.70 MEN1 (0.61) KDM4EPOLBCYP3A4MAPTTPMT
SCHEMBL5885507 0.69 KDM4E (0.46) KDM4EPOLBHSD17B10USP2GAA
SCHEMBL2865066 0.69 POLB (0.40) KDM4EPOLBHSD17B10USP2GAA
SCHEMBL28942504 0.68 ACHE (0.41) KDM4EGAAHTTCYP3A4MAPT
SCHEMBL28942483 0.68 ACHE (0.41) GAAHTTCYP3A4MAPTALDH1A1
SCHEMBL131423 0.67 CA1 (0.56) KDM4EPOLBHSD17B10GAAMAPT
SCHEMBL1134668 0.66 TPMT (0.73) KDM4EPOLBGAACYP3A4MAPT
SCHEMBL17655659 0.66 TPMT (0.53) KDM4EPOLBGAACYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066269-B1 TRISUBSTITUTED 1,3,5-TRIAZINE DERIVATIVES FOR TREATMENT OF HIV INFECTIONS JANSSEN PHARMACEUTICA NV (BE) 2005-05-11 EP disclosed
US-6774235-B2 HAVING HIV REPLICATION INHIBITING PROPERTIES. JANSSEN PHARMACEUTICA N.V. (BE) 2004-08-10 US disclosed
US-20020115668-A1 Trisubstituted 1,3,5-triazine derivatives DAEYAERT FREDERIK FRANS DESIRE (BE) 2002-08-22 US disclosed
US-6372729-B1 TREATMENT OF VIRAL DISEASES SUCH AS AIDS JANSSEN PHARMACEUTICA N.V. (BE) 2002-04-16 US disclosed
EP-1066269-A1 TRISUBSTITUTED 1,3,5-TRIAZINE DERIVATIVES FOR TREATMENT OF HIV INFECTIONS JANSSEN PHARMACEUTICA N.V. (BE) 2001-01-10 EP disclosed
US-6150360-A ADMINISTERING TO A PATIENT SUFFERING FROM HUMAN IMMUNODEFICIENCY VIRUS INFECTION A TRISUBSTITUTED 1,3,5-TRIAZINE DERIVATIVE JANSSEN PHARMACEUTICA N.V. (BE) 2000-11-21 US disclosed
WO-1999050256-A1 TRISUBSTITUTED 1,3,5-TRIAZINE DERIVATIVES FOR TREATMENT OF HIV INFECTIONS JANSSEN PHARMACEUTICA N.V. (BE) 1999-10-07 WO disclosed
US-4785010-A AGING RESISTANCE OF HUMANS CASSELLA AKTIENGESELLSCHAFT (DE) 1988-11-15 US disclosed
EP-0124067-B1 2-(AMINOALKYL)-PYRROLE DERIVATIVES, PROCESS FOR THEIR MANUFACTURE AND THEIR USE CASSELLA Aktiengesellschaft (DE) 1986-12-17 EP disclosed
EP-0124067-A1 2-(Aminoalkyl)-pyrrole derivatives, process for their manufacture and their use CASSELLA Aktiengesellschaft (DE) 1984-11-07 EP 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-20020115668-A1 Trisubstituted 1,3,5-triazine derivatives XDH, CCR5, CXCR1 KDM4E 2744/4885POLB 2618/4885HSD17B10 1218/4885

“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.