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SCHEMBL29613390

SCHEMBL29613390

CC(C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 10/20 0.55
▸ GLP1R P43220 5/20 0.53
▸ CTSL P07711 3/20 0.53
▸ CTSS P25774 3/20 0.53
▸ CTSK P43235 3/20 0.53
▸ CTSH P09668 1/20 0.53
▸ GRPR P30550 1/20 0.51

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
SCHEMBL29434537 0.93 GLP1R (0.57) IL23RGLP1RGRPR
SCHEMBL29871710 0.93 CTSL (0.53) IL23RGLP1RCTSLCTSSCTSK
SCHEMBL30183034 0.92 GLP1R (0.55) IL23RGLP1RCTSLCTSSCTSK
SCHEMBL29484310 0.92 CTSL (0.53) IL23RGLP1RCTSLCTSSCTSK
SCHEMBL30064553 0.91 GLP1R (0.58) IL23RGLP1RGRPR
SCHEMBL30932144 0.90 GLP1R (0.59) GLP1R
SCHEMBL30496771 0.90 CTSL (0.50) IL23RGLP1RCTSLCTSSCTSK
SCHEMBL29740501 0.89 GLP1R (0.59) IL23RGLP1R
SCHEMBL30932143 0.88 GLP1R (0.60) GLP1R
SCHEMBL29489380 0.88 CTSL (0.53) IL23RGLP1RCTSLCTSSCTSK

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
EP-4259187-A1 GENOMIC EDITING OF COMPLEMENT Apellis Pharmaceuticals, Inc. (US) 2023-10-18 — — EP disclosed
WO-2022125955-A1 GENOMIC EDITING OF COMPLEMENT APELLIS PHARMACEUTICALS, INC. (US) 2022-06-16 — — WO disclosed
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