SCHEMBL18771568

SCHEMBL18771568

C[C@H](NC(=O)OC1CC2CC(C2)C1)C(=O)N1CC[C@@H](C)[C@H]1C(N)=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.31
▸ PREP P48147 3/20 0.31
▸ FAP Q12884 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL23394429 0.85 PIK3CA (0.32) DPP4
SCHEMBL23394685 0.79 PREP (0.37) DPP4PREPFAP
SCHEMBL18771926 0.78 PREP (0.32) PREPFAP
SCHEMBL18675246 0.76 PIK3CA (0.37) DPP4PREPFAPALDH1A1
SCHEMBL883412 0.70 ELANE (0.39) —
SCHEMBL8133669 0.68 PREP (0.41) PREPFAP
SCHEMBL17282592 0.65 PREP (0.49) DPP4PREPFAP
SCHEMBL12943482 0.65 PIK3CA (0.39) —
SCHEMBL20629567 0.65 PIK3CA (0.39) DPP4
SCHEMBL18681115 0.64 PREP (0.36) DPP4PREPFAP

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
EP-3159345-A1 INHIBITORS OF HEPATITIS C VIRUS Gilead Sciences, Inc. (US) 2017-04-26 — — EP disclosed
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