SCHEMBL414400

SCHEMBL414400

CSCCC(N)C(=O)NC(CC(C)C)C(=O)NC(Cc1c[nH]cn1)C(=O)NC(CC(C)C)C(=O)NC(CS)C(=O)NC(CO)C(=O)NCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 0.41
▸ CALCR P30988 3/20 0.39
▸ KEAP1 Q14145 1/20 0.37
▸ EGFR P00533 1/20 0.36
▸ OPRM1 P35372 1/20 0.36
▸ OPRD1 P41143 1/20 0.36
▸ FNTA P49354 6/20 0.36
▸ FNTB P49356 6/20 0.36
▸ PGGT1B P53609 2/20 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
SCHEMBL414401 1.00 APLNR (0.41) APLNRCALCRKEAP1EGFROPRM1
SCHEMBL415551 0.95 APLNR (0.42) APLNRCALCRFNTAFNTBPGGT1B
SCHEMBL415550 0.95 APLNR (0.42) APLNRCALCRFNTAFNTBPGGT1B
SCHEMBL412323 0.95 APLNR (0.42) APLNRCALCRKEAP1FNTAFNTB
SCHEMBL412324 0.95 APLNR (0.42) APLNRCALCRKEAP1FNTAFNTB
SCHEMBL416409 0.91 OPRM1 (0.39) APLNREGFROPRM1OPRD1
SCHEMBL416410 0.91 OPRM1 (0.39) APLNREGFROPRM1OPRD1
SCHEMBL29941145 0.87 CCKAR (0.42) CALCRKEAP1EGFR
SCHEMBL31256943 0.85 OPRM1 (0.42) EGFROPRM1OPRD1
SCHEMBL30822875 0.83 FOLH1 (0.41) FNTAFNTBPGGT1B

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-20120020878-A1 FUSOGENIC PROPERTIES OF SAPOSIN C AND RELATED PROTEINS AND PEPTIDES FOR APPLICATION TO TRANSMEMBRANE DRUG DELIVERY SYSTEMS CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2012-01-26 — — US disclosed
Send feedback