SCHEMBL29379367

SCHEMBL29379367

CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 4/20 0.55
▸ IL23R Q5VWK5 6/20 0.53
▸ PRKACB P22694 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
SCHEMBL30945346 0.96 MAGI3 (0.52) GHSRIL23R
SCHEMBL30130526 0.96 IL23R (0.55) GHSRIL23R
SCHEMBL30130542 0.96 IL23R (0.55) GHSRIL23R
SCHEMBL7154339 0.95 KISS1R (0.56) GHSRIL23R
SCHEMBL7154343 0.95 KISS1R (0.56) GHSRIL23R
SCHEMBL30093017 0.95 GHSR (0.55) GHSRIL23R
SCHEMBL30092977 0.95 GHSR (0.55) GHSRIL23R
SCHEMBL31110538 0.95 KISS1R (0.54) GHSRIL23R
SCHEMBL29732610 0.95 KISS1R (0.54) GHSRIL23R
SCHEMBL30305295 0.95 KISS1R (0.54) GHSRIL23R

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
US-20220128556-A1 METHODS OF DIAGNOSING DISEASE 4D Pharma Cork Limited (IE) 2022-04-28 — — US disclosed
CN-114040986-A Method of diagnosing disease 4D制药科克有限公司 2022-02-11 — — CN disclosed
EP-3947743-A1 METHODS OF DIAGNOSING DISEASE 4D Pharma Cork Limited (IE) 2022-02-09 — — EP disclosed
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