SCHEMBL31649037

SCHEMBL31649037

N[C@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]2CCCC[C@@H]21

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.71
▸ DPP7 Q9UHL4 2/20 0.59
▸ NLN Q9BYT8 3/20 0.53
▸ CYP3A4 P08684 1/20 0.51
▸ SLC7A5 Q01650 1/20 0.51
▸ ARG1 P05089 2/20 0.45
▸ ARG2 P78540 1/20 0.45
▸ TRHR P34981 1/20 0.45
▸ HRH2 P25021 1/20 0.44
▸ HRH1 P35367 1/20 0.44
▸ PPM1B O75688 2/20 0.42
▸ REN P00797 1/20 0.41
▸ BTK Q06187 2/20 0.41

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
SCHEMBL31649400 0.85 DPP4 (0.53) DPP4DPP7NLNTRHRREN
SCHEMBL26625862 0.84 DPP4 (0.71) DPP4DPP7NLNCYP3A4SLC7A5
SCHEMBL27210419 0.84 DPP4 (0.71) DPP4DPP7NLNCYP3A4SLC7A5
SCHEMBL30477930 0.84 DPP4 (0.71) DPP4DPP7NLNCYP3A4SLC7A5
SCHEMBL27484466 0.83 DPP4 (0.69) DPP4DPP7NLNCYP3A4SLC7A5
SCHEMBL30839655 0.80 DPP4 (0.66) DPP4DPP7NLNCYP3A4SLC7A5
SCHEMBL31649050 0.74 DPP7 (0.60) DPP4DPP7
SCHEMBL22300350 0.73 DPP4 (0.56) DPP4DPP7NLNTRHRREN
Histidine SCHEMBL5491751 0.72 CYP3A4 (0.74) DPP4DPP7CYP3A4SLC7A5PPM1B
SCHEMBL27776880 0.72 CYP3A4 (0.57) DPP4NLNCYP3A4SLC7A5

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
WO-2025132943-A1 DECAHYDROQUINOLINES AS DNA POLYMERASE THETA INHIBITORS BREAKPOINT THERAPEUTICS GMBH (DE) 2025-06-26 — — WO disclosed
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