SCHEMBL6132224

SCHEMBL6132224

COc1ccc(C(=O)N(NC(N)=O)c2ccc(OC)nc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OXTR P30559 7/20 0.49
NNMT P40261 2/20 0.49
MKNK1 Q9BUB5 1/20 0.45
MKNK2 Q9HBH9 1/20 0.45
LMNA P02545 2/20 0.43
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
PARP10 Q53GL7 2/20 0.41
PARP1 P09874 1/20 0.41
PARP2 Q9UGN5 1/20 0.41
PARP4 Q9UKK3 1/20 0.41
MAPT P10636 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
MAOB P27338 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 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
SCHEMBL6132335 0.93 NNMT (0.52) OXTRNNMTMKNK1MKNK2LMNA
SCHEMBL6682866 0.89 OXTR (0.48) OXTRNNMTMKNK1MKNK2LMNA
SCHEMBL6681336 0.86 MEN1 (0.54) OXTRPARP10MAOBKMT2A
SCHEMBL4027589 0.86 CA1 (0.51) LMNACA1CA2PARP10PARP1
SCHEMBL6132418 0.75 CA1 (0.49) LMNACA1CA2PARP10PARP1
SCHEMBL19211861 0.71 OXTR (0.48) OXTRNNMTMKNK1MKNK2LMNA
SCHEMBL6539765 0.70 NNMT (0.54) NNMTMKNK1MKNK2LMNAMAPT
SCHEMBL31676582 0.68 PTGS2 (0.55) CA1CA2MAPTHPGDMAOB
SCHEMBL26036861 0.68 NNMT (0.67) OXTRNNMTMKNK1MKNK2
SCHEMBL29975550 0.67 NNMT (1.00) OXTRNNMTMKNK1MKNK2CA1

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-6927230-B2 Triazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-08-09 US disclosed
EP-1442026-A1 TRIAZOLE DERIVATIVES AS CYCLOOXYGENASE (COX) INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-04 EP disclosed
US-20030191155-A1 Triazole derivatives ASTELLAS PHARMA INC. (JP) 2003-10-09 US disclosed
WO-2003040110-A1 TRIAZOLE DERIVATIVES AS CYCLOOXYGENASE (COX) INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-15 WO 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-20030191155-A1 Triazole derivatives CBR1, CBR3, CYP1B1 OXTR 242/4885NNMT 1684/4885MKNK1 3072/4885

“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.