SCHEMBL29630460

SCHEMBL29630460

O=C(O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TRHR P34981 5/20 0.39
▸ REN P00797 1/20 0.39
▸ DPP4 P27487 5/20 0.36
▸ DPP8 Q6V1X1 2/20 0.36
▸ FAP Q12884 1/20 0.36
▸ DPP9 Q86TI2 1/20 0.36
▸ DPP7 Q9UHL4 1/20 0.36
▸ CMA1 P23946 2/20 0.36
▸ ANPEP P15144 2/20 0.36
▸ LNPEP Q9UIQ6 1/20 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
SCHEMBL30997447 0.98 TRHR (0.40) TRHRRENDPP4DPP8FAP
SCHEMBL29591797 0.97 REN (0.43) TRHRRENANPEPLNPEP
SCHEMBL29630400 0.95 REN (0.44) TRHRRENANPEPLNPEP
SCHEMBL29630379 0.89 REN (0.39) REN
SCHEMBL29547718 0.86 REN (0.50) REN
SCHEMBL38666572 0.85 REN (0.46) REN
SCHEMBL31467233 0.85 TRHR (0.43) TRHRRENCMA1
SCHEMBL18048893 0.84 CTSC (0.45) TRHRRENDPP7
SCHEMBL18048894 0.84 CTSC (0.45) TRHRRENDPP7
SCHEMBL29791111 0.83 ALDH1A1 (0.48) RENDPP4DPP8CMA1

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
US-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 — — US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 — — US disclosed
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