SCHEMBL31649254

SCHEMBL31649254

NC[C@H](C(=O)N1CCC[C@H]2CCCC[C@@H]21)N(Cc1ccc(Cl)cc1)C1CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.49
▸ DRD4 P21917 1/20 0.49
▸ HSD11B1 P28845 2/20 0.43
▸ DPP4 P27487 3/20 0.43
▸ DPP7 Q9UHL4 6/20 0.41
▸ FAP Q12884 1/20 0.41
▸ DPP8 Q6V1X1 1/20 0.41
▸ DPP9 Q86TI2 1/20 0.41
▸ CCR1 P32246 8/20 0.39
▸ HPGD P15428 1/20 0.38

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
SCHEMBL31649236 0.92 DRD2 (0.47) DRD2DRD4HSD11B1DPP4DPP7
SCHEMBL31649338 0.83 DRD2 (0.43) DRD2DRD4HSD11B1DPP4CCR1
SCHEMBL31649076 0.82 DRD2 (0.43) DRD2DRD4HSD11B1DPP4
SCHEMBL31649010 0.78 HSD11B1 (0.38) DRD2DRD4HSD11B1CCR1
SCHEMBL31649339 0.78 DPP4 (0.42) DRD2DRD4HSD11B1DPP4DPP7
SCHEMBL31649089 0.75 DPP4 (0.41) HSD11B1DPP4DPP7FAPDPP8
SCHEMBL31649406 0.75 KMT2A (0.40) DPP7
SCHEMBL31649053 0.75 KMT2A (0.40) DPP7
SCHEMBL31649221 0.75 HSD11B1 (0.40) DRD2DRD4HSD11B1
SCHEMBL31649260 0.75 HTR2A (0.41) DPP4DPP7FAPDPP8DPP9

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