SCHEMBL1373230

SCHEMBL1373230

CSCCC(NC(C)=O)C(=O)N1CCCC1C(=O)NC(CCCNC(=N)N)C(=O)NCC(N)=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 0.44
▸ OPRM1 P35372 8/20 0.44
▸ OPRK1 P41145 8/20 0.44
▸ CTSL P07711 3/20 0.43
▸ CTSS P25774 3/20 0.43
▸ CTSK P43235 3/20 0.43
▸ CTSH P09668 1/20 0.43
▸ MC4R P32245 1/20 0.41
▸ MC5R P33032 1/20 0.41
▸ MC3R P41968 1/20 0.41
▸ MC1R Q01726 1/20 0.41
▸ NMUR2 Q9GZQ4 2/20 0.41
▸ NMUR1 Q9HB89 2/20 0.41

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
SCHEMBL1373233 1.00 APLNR (0.44) APLNROPRM1OPRK1CTSLCTSS
SCHEMBL1371099 0.90 OPRM1 (0.44) APLNROPRM1OPRK1CTSLCTSS
SCHEMBL1371104 0.90 OPRM1 (0.44) APLNROPRM1OPRK1CTSLCTSS
SCHEMBL30185759 0.87 APLNR (0.48) APLNROPRM1OPRK1CTSLCTSS
SCHEMBL23600801 0.86 APLNR (0.39) APLNRNMUR2NMUR1
SCHEMBL23572656 0.86 APLNR (0.39) APLNRNMUR2NMUR1
SCHEMBL23572657 0.86 APLNR (0.39) APLNRNMUR2NMUR1
SCHEMBL31157707 0.84 CTSL (0.51) OPRM1OPRK1CTSLCTSSCTSK
SCHEMBL31072471 0.83 NMUR2 (0.46) APLNROPRM1OPRK1NMUR2NMUR1
SCHEMBL30979610 0.82 NMUR2 (0.39) APLNROPRM1OPRK1NMUR2NMUR1

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-20160263235-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC (CA) 2016-09-15 — — US disclosed
EP-2794663-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF Angiochem Inc. (CA) 2014-10-29 — — EP disclosed
US-20110288011-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC. (CA) 2011-11-24 — — US disclosed
WO-2010063124-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC. (CA) 2010-06-10 — — 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 (2 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-20160263235-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF VIP, SLC1A5, SLC47A1 APLNR 179/4885OPRM1 3822/4885OPRK1 3911/4885
US-20110288011-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF VIP, SLC1A5, SLC47A1 APLNR 179/4885OPRM1 3822/4885OPRK1 3911/4885

“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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