SCHEMBL31649304

SCHEMBL31649304

CNC[C@H](C(=O)N1CCC[C@H]2CCCC[C@@H]21)N(Cc1ccccc1C)C1CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ DPP4 P27487 1/20 0.39
▸ FAP Q12884 1/20 0.39
▸ DPP8 Q6V1X1 1/20 0.39
▸ DPP9 Q86TI2 1/20 0.39
▸ HSD11B1 P28845 6/20 0.37
▸ HSD17B1 P14061 1/20 0.36
▸ FFAR1 O14842 1/20 0.36
▸ CNR2 P34972 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ TACR1 P25103 1/20 0.34
▸ EPHX2 P34913 1/20 0.34
▸ TP53 P04637 2/20 0.34
▸ MAPT P10636 1/20 0.34

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
SCHEMBL31649065 0.83 TACR1 (0.39) NPC1RAB9ASMN1; SMN2DPP4FAP
SCHEMBL31649010 0.82 HSD11B1 (0.38) NPC1RAB9ASMN1; SMN2HSD11B1HSD17B1
SCHEMBL31649284 0.82 HSD11B1 (0.39) DPP4DPP8HSD11B1POLBTDP1
SCHEMBL31649243 0.80 KMT2A (0.41) SMN1; SMN2POLBTDP1TACR1MAPT
SCHEMBL31649455 0.80 KMT2A (0.41) SMN1; SMN2POLBTDP1TACR1MAPT
SCHEMBL31649089 0.80 DPP4 (0.41) DPP4FAPDPP8DPP9HSD11B1
SCHEMBL31649051 0.79 HTR2A (0.40) POLB
SCHEMBL31649016 0.79 HRH3 (0.36) DPP4HSD11B1MAPT
SCHEMBL31649005 0.72 SMN1; SMN2 (0.41) SMN1; SMN2POLBTDP1TACR1
SCHEMBL19002341 0.71 SMN1; SMN2 (0.49) NPC1RAB9ASMN1; SMN2DPP4FAP

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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