SCHEMBL31560575

SCHEMBL31560575

O=C(NC1(CN2CCC2)CC1)C1(c2ccc(Cl)cc2)CCC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.52
▸ HSD11B1 P28845 7/20 0.52
▸ LMNA P02545 2/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ FFAR2 O15552 3/20 0.44
▸ HDAC1 Q13547 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ AVPR1A P37288 1/20 0.40
▸ SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL31560707 0.96 HSD11B1 (0.52) HDAC4HSD11B1LMNAALDH1A1HDAC1
SCHEMBL31560589 0.87 HSD11B1 (0.49) HDAC4HSD11B1LMNAALDH1A1HDAC1
SCHEMBL31560538 0.87 MAPT (0.42) HDAC4HSD11B1LMNAALDH1A1SMN1; SMN2
SCHEMBL31560526 0.87 HDAC4 (0.50) HDAC4HSD11B1LMNAALDH1A1SMN1; SMN2
SCHEMBL31560746 0.85 TRPV1 (0.41) HDAC4HSD11B1ALDH1A1
SCHEMBL31560677 0.83 OPRM1 (0.40) HDAC4HSD11B1LMNANPSR1
SCHEMBL31560539 0.83 HSD11B1 (0.47) HDAC4HSD11B1LMNAALDH1A1HDAC1
SCHEMBL31560749 0.83 HSD11B1 (0.50) HDAC4HSD11B1LMNAALDH1A1SMN1; SMN2
SCHEMBL31560715 0.81 HSD11B1 (0.40) HDAC4HSD11B1ALDH1A1
SCHEMBL31560772 0.81 HDAC4 (0.53) HDAC4LMNAALDH1A1SMN1; SMN2

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-2025074305-A1 N-(1-(AMINOMETHYL)CYCLOPROPYL)(ARYL OR HETEROARYL) CARBOXAMIDE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-04-10 — — WO claimed
WO-2025074305-A1 N-(1-(AMINOMETHYL)CYCLOPROPYL)(ARYL OR HETEROARYL) CARBOXAMIDE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-04-10 — — WO disclosed
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