SCHEMBL31560749

SCHEMBL31560749

O=C(NC1(CN2CCC2)CC1)C1(c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.50
▸ HDAC4 P56524 2/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ HTT P42858 1/20 0.46
▸ LMNA P02545 4/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ MAPK1 P28482 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ AKR1C1 Q04828 1/20 0.41
▸ ELOVL1 Q9BW60 1/20 0.41
▸ ALDH1A1 P00352 3/20 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
SCHEMBL31560526 0.96 HDAC4 (0.50) HSD11B1HDAC4SMN1; SMN2HTTLMNA
SCHEMBL31560652 0.91 ELOVL1 (0.44) HSD11B1HDAC4SMN1; SMN2HTTLMNA
SCHEMBL31560634 0.89 HDAC4 (0.40) HSD11B1HDAC4SMN1; SMN2HTTLMNA
SCHEMBL31560539 0.86 HSD11B1 (0.47) HSD11B1HDAC4SMN1; SMN2LMNAELOVL1
SCHEMBL31560707 0.86 HSD11B1 (0.52) HSD11B1HDAC4SMN1; SMN2HTTLMNA
SCHEMBL31560677 0.86 OPRM1 (0.40) HSD11B1HDAC4LMNANPSR1MEN1
SCHEMBL31560520 0.85 HDAC4 (0.54) HSD11B1HDAC4NPSR1MEN1KMT2A
SCHEMBL31560499 0.85 ALDH1A1 (0.44) HDAC4SMN1; SMN2LMNANPSR1MEN1
SCHEMBL31560715 0.85 HSD11B1 (0.40) HSD11B1HDAC4MEN1KMT2AALDH1A1
SCHEMBL31560538 0.83 MAPT (0.42) HSD11B1HDAC4SMN1; SMN2LMNANPSR1

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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