SCHEMBL14129393

SCHEMBL14129393

Cc1ccc(NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2ccccc2)NC(=O)COCC(=O)NCCOCCOCCn2cc(CNC(=O)C3CCC(CN4C(=O)CC(C)C4=O)CC3)nn2)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 2/20 0.39
▸ TTR P02766 1/20 0.38
▸ IL2 P60568 1/20 0.38
▸ CCKBR P32239 3/20 0.38
▸ F2R P25116 1/20 0.37
▸ FOLH1 Q04609 1/20 0.37
▸ CCKAR P32238 2/20 0.35
▸ PLG P00747 2/20 0.35
▸ APLNR P35414 1/20 0.35
▸ NMUR2 Q9GZQ4 2/20 0.34
▸ NMUR1 Q9HB89 2/20 0.34
▸ KLKB1 P03952 2/20 0.34
▸ PLAU P00749 1/20 0.34
▸ F11 P03951 1/20 0.34
▸ IL23R Q5VWK5 2/20 0.34
▸ F2RL1 P55085 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
SCHEMBL12342513 1.00 OPRK1 (0.39) OPRK1TTRIL2CCKBRF2R
SCHEMBL12342493 0.96 OPRK1 (0.40) OPRK1TTRIL2CCKBRF2R
SCHEMBL12377406 0.95 CCKBR (0.39) OPRK1TTRIL2CCKBRF2R
SCHEMBL14329043 0.94 CCKBR (0.39) OPRK1TTRIL2CCKBRF2R
SCHEMBL25795377 0.91 CCKBR (0.40) TTRIL2CCKBRFOLH1CCKAR
SCHEMBL12342504 0.89 TTR (0.44) OPRK1TTRIL2CCKBRF2R
SCHEMBL22969740 0.89 TTR (0.38) OPRK1TTRIL2F2RFOLH1
SCHEMBL23180460 0.84 TTR (0.37) OPRK1TTRIL2F2RFOLH1
SCHEMBL24176337 0.83 TTR (0.37) OPRK1TTRIL2F2RFOLH1
SCHEMBL29351004 0.83 TTR (0.46) TTRIL2F2RFOLH1PLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080166363-A1 Improved targetting IMMUNOMEDICS, INC. 2008-07-10 — — 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 (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-20080166363-A1 Improved targetting CD47, CYTH3, FCGR2A OPRK1 4728/4885TTR 4273/4885IL2 893/4885

“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.

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