SCHEMBL29823986

SCHEMBL29823986

c1ccc(CN2CCC(N(CCc3ccccn3)Cc3cccc(CNCc4ccccn4)c3)C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ CXCR4 P61073 2/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ RAB9A P51151 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ PGR P06401 1/20 0.38
▸ BCHE P06276 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ ACKR3 P25106 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ DRD2 P14416 1/20 0.37
▸ DRD4 P21917 1/20 0.37
▸ DRD3 P35462 1/20 0.37

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
SCHEMBL1872883 1.00 MEN1 (0.41) MEN1KMT2AALDH1A1CXCR4SIGMAR1
SCHEMBL29823258 0.92 ALDH1A1 (0.43) MEN1KMT2AALDH1A1CXCR4SIGMAR1
SCHEMBL1877208 0.92 ALDH1A1 (0.43) MEN1KMT2AALDH1A1CXCR4SIGMAR1
SCHEMBL29823344 0.87 CXCR4 (0.51) MEN1KMT2AALDH1A1CXCR4SIGMAR1
SCHEMBL1879660 0.87 CXCR4 (0.51) MEN1KMT2AALDH1A1CXCR4SIGMAR1
SCHEMBL5790256 0.85 KMT2A (0.41) MEN1KMT2AALDH1A1CXCR4RAB9A
SCHEMBL1873995 0.84 KMT2A (0.50) MEN1KMT2AALDH1A1RAB9AL3MBTL1
SCHEMBL29823211 0.84 KMT2A (0.50) MEN1KMT2AALDH1A1RAB9AL3MBTL1
SCHEMBL29823432 0.84 CXCR4 (0.49) CXCR4SIGMAR1BCHECYP2D6CYP3A4
SCHEMBL1877188 0.84 CXCR4 (0.49) CXCR4SIGMAR1BCHECYP2D6CYP3A4

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
WO-2025230907-A1 A CXCR4 ANTAGONIST, A STATS ACTIVATOR, AND/OR AN AGENT THAT INCREASES NITRIC OXIDE CONTENT FOR USE IN METHODS OF IMPROVING NERVE REGENERATION THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-11-06 — — WO disclosed
EP-4308694-A1 DOSING REGIMENS FOR HEMATOPOIETIC STEM CELL MOBILIZATION FOR STEM CELL TRANSPLANTS IN MULTIPLE MYELOMA PATIENTS Magenta Therapeutics, Inc. (US) 2024-01-24 — — EP disclosed
EP-4143302-A1 METHODS AND COMPOSITIONS FOR TRANSDUCING HEMATOPOIETIC STEM AND PROGENITOR CELLS IN VIVO Magenta Therapeutics, Inc. (US) 2023-03-08 — — EP disclosed
WO-2022197776-A1 DOSING REGIMENS FOR HEMATOPOIETIC STEM CELL MOBILIZATION FOR STEM CELL TRANSPLANTS IN MULTIPLE MYELOMA PATIENTS Magenta Therapeutics, Inc. (US) 2022-09-22 — — WO disclosed
EP-4051298-A1 DOSING REGIMENS FOR THE MOBILIZATION OF HEMATOPOIETIC STEM AND PROGENTOR CELLS Magenta Therapeutics, Inc. (US) 2022-09-07 — — EP disclosed
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