SCHEMBL31472162

SCHEMBL31472162

O=C(CCCl)N1CCOc2cc(Br)ccc21

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 3/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ NOTUM Q6P988 1/20 0.40

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
SCHEMBL4824285 0.85 NAAA (0.49) TP53L3MBTL1LMNAMAPTALDH1A1
SCHEMBL5270784 0.79 NOTUM (0.63) TP53LMNAMAPTNOTUM
SCHEMBL29209099 0.76 LMNA (0.46) LMNAMAPTHTTRAB9APOLB
SCHEMBL30336438 0.76 LMNA (0.46) LMNAMAPTHTTRAB9APOLB
SCHEMBL304544 0.73 PDK1 (0.43) LMNAMAPTHTTRAB9APOLB
SCHEMBL30336534 0.73 LMNA (0.51) TP53LMNAMAPTRXFP1NOTUM
SCHEMBL5276056 0.73 USP30 (0.50) LMNANOTUM
SCHEMBL29209024 0.73 LMNA (0.51) TP53LMNAMAPTRXFP1NOTUM
SCHEMBL13598153 0.72 RXFP1 (0.46) TP53L3MBTL1MAPTALDH1A1HTT
SCHEMBL31542297 0.72 NPC1 (0.51) TP53L3MBTL1MAPTRAB9ANOTUM

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-2025026270-A1 BENZO NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2025-02-06 — — WO disclosed
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