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SCHEMBL29628789

SCHEMBL29628789

CC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(N)=O)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 1/20 0.52
▸ APLNR P35414 1/20 0.51
▸ NMUR2 Q9GZQ4 5/20 0.50
▸ NMUR1 Q9HB89 4/20 0.50
▸ AKT1 P31749 3/20 0.49
▸ GRB2 P62993 1/20 0.49
▸ OPRD1 P41143 4/20 0.47

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
SCHEMBL29628862 0.90 IL23R (0.48) KEAP1APLNRNMUR2NMUR1
SCHEMBL28923852 0.80 BDKRB2 (0.50) KEAP1NMUR2NMUR1GRB2OPRD1
SCHEMBL29367074 0.80 BDKRB2 (0.50) KEAP1NMUR2NMUR1GRB2OPRD1
SCHEMBL30751611 0.77 APLNR (0.46) APLNROPRD1
SCHEMBL30065432 0.77 APLNR (0.49) APLNR
SCHEMBL29377971 0.76 F2 (0.55) APLNRGRB2OPRD1
SCHEMBL29364214 0.76 KEAP1 (0.46) KEAP1AKT1GRB2OPRD1
SCHEMBL29462901 0.76 KEAP1 (0.46) KEAP1AKT1GRB2OPRD1
SCHEMBL30882887 0.75 ITGB3 (0.55) —
SCHEMBL29637996 0.74 APLNR (0.46) APLNRNMUR2NMUR1

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
CN-114634575-B Development and application of complement inhibitor 康诺亚生物医药科技（成都）有限公司 2025-04-11 — — CN disclosed
WO-2022127834-A1 DEVELOPMENT AND APPLICATION OF COMPLEMENT INHIBITOR 康诺亚生物医药科技（成都）有限公司 2022-06-23 — — WO disclosed
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