SCHEMBL30918790

SCHEMBL30918790

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NMUR2 Q9GZQ4 5/20 0.49
▸ NMUR1 Q9HB89 5/20 0.49
▸ APLNR P35414 1/20 0.47
▸ OPRM1 P35372 6/20 0.46
▸ OPRK1 P41145 6/20 0.46
▸ RAMP3 O60896 6/20 0.45
▸ CALCR P30988 6/20 0.45
▸ NTSR1 P30989 1/20 0.44

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
SCHEMBL30099574 0.93 NMUR2 (0.49) NMUR2NMUR1APLNROPRM1OPRK1
SCHEMBL31303210 0.88 APLNR (0.47) NMUR2NMUR1APLNRRAMP3CALCR
SCHEMBL30099619 0.88 MC4R (0.45) NMUR2NMUR1APLNROPRM1OPRK1
SCHEMBL29408366 0.87 APLNR (0.41) NMUR2NMUR1APLNROPRM1OPRK1
SCHEMBL30918792 0.87 NMUR2 (0.53) NMUR2NMUR1APLNRRAMP3CALCR
SCHEMBL31249463 0.86 RAMP3 (0.44) NMUR2NMUR1OPRM1OPRK1RAMP3
SCHEMBL10340262 0.86 ACE (0.42) APLNROPRM1OPRK1
SCHEMBL4190057 0.86 ACE (0.42) APLNROPRM1OPRK1
SCHEMBL7444428 0.86 ACE (0.42) APLNROPRM1OPRK1
SCHEMBL4190053 0.86 ACE (0.42) APLNROPRM1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117903240-A Logic gate-type polypeptide with tumor specificity, probe, preparation method and application 甘肃天际生物科技有限公司 2024-04-19 — — CN claimed
CN-117903240-B Logic gate-type polypeptide with tumor specificity, probe, preparation method and application 甘肃天际生物科技有限公司 2024-12-24 — — CN disclosed
CN-117903240-A Logic gate-type polypeptide with tumor specificity, probe, preparation method and application 甘肃天际生物科技有限公司 2024-04-19 — — CN disclosed
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