SCHEMBL7363337

SCHEMBL7363337

CCS(=O)(=O)N[C@H](Cc1ccccc1)C(=O)NC(=O)[C@@H]1CCCN1Cc1ccc(C=NN)c(O)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.39
F2 P00734 1/20 0.38
OPRM1 P35372 2/20 0.38
OPRD1 P41143 2/20 0.38
OPRK1 P41145 2/20 0.38
ACE P12821 4/20 0.37
ACE2 Q9BYF1 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL7463647 0.86 F2 (0.42) CCR4F2OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7156977 0.85 F2 (0.43) CCR4F2OPRM1OPRD1OPRK1
SCHEMBL7102590 0.82 ST14 (0.40) CCR4F2ACEACE2MEN1
SCHEMBL7105056 0.82 F2 (0.46) F2
SCHEMBL7102491 0.82 F2 (0.42) CCR4F2ACENPSR1
SCHEMBL7106036 0.82 F2 (0.53) F2NPSR1
Hydrochloric Acid SCHEMBL7140906 0.81 F2 (0.54) F2
SCHEMBL7363339 0.81 TMPRSS11D (0.49) F2
Hydrochloric Acid SCHEMBL7156980 0.80 TMPRSS11D (0.49) F2
SCHEMBL7363788 0.77 TMPRSS11D (0.45) F2

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-20010018423-A1 Anticoagulant agents KLIMKOWSKI VALENTINE J (US) 2001-08-30 US claimed
WO-1997049404-A1 ANTICOAGULANT AGENTS ELI LILLY AND COMPANY (US) 1997-12-31 WO claimed

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-20010018423-A1 Anticoagulant agents SERPINC1, F12, F11 CCR4 2229/4885F2 4/4885OPRM1 3003/4885

“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.