SCHEMBL27139528

SCHEMBL27139528

O=C1CCN(c2cc(C(=O)N3CCC(OCCCN4CCN(C(=O)O)CC4)CC3)ccc2Cl)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 6/20 0.39
▸ DRD2 P14416 3/20 0.37
▸ MAPK14 Q16539 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ HTR2A P28223 1/20 0.35
▸ NAMPT P43490 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ LSS P48449 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ BCHE P06276 1/20 0.35
▸ ADRB2 P07550 1/20 0.34
▸ MGLL Q99685 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
SCHEMBL27137321 0.91 HRH3 (0.40) HRH3DRD2NAMPTLSSTSHR
SCHEMBL27120901 0.90 KMT2A (0.41) HRH3HTTKMT2AADRB2
SCHEMBL27147744 0.89 NAMPT (0.36) NAMPTLSSTSHRMGLL
SCHEMBL27140667 0.89 CRBN (0.39) HRH3DRD2MEN1KMT2A
SCHEMBL29201711 0.87 HTT (0.39) HRH3DRD2HTTHTR2AMEN1
SCHEMBL30267158 0.87 LSS (0.38) NAMPTLSSTSHRMGLL
SCHEMBL27146833 0.87 MGLL (0.38) HRH3DRD2MAPK14HTTMEN1
SCHEMBL27152786 0.87 HTT (0.39) HRH3DRD2HTTHTR2AMEN1
SCHEMBL29201758 0.85 HTT (0.40) DRD2HTTADRB2MGLL
SCHEMBL28868794 0.85 MGLL (0.40) MEN1KMT2ATSHRMGLL

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4328219-A1 SOS1 DEGRADING AGENT AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shanghai Leadingtac Pharmaceutical Co. Ltd. (CN) 2024-02-28 — — EP disclosed
CN-115232114-B SOS1 degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2023-12-19 — — CN disclosed
CN-115232114-A SOS1 degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2022-10-25 — — CN disclosed
CN-115232111-A SOS1 degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2022-10-25 — — CN disclosed
CN-115232108-A SOS1 degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2022-10-25 — — CN disclosed
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