SCHEMBL31014086

SCHEMBL31014086

CN(C)CCOc1cc2c(c(N[C@H]3CCOC3)c1)CN(C(=O)O)CC2

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PIP5K1C O60331 1/20 0.39
▸ MTHFD2 P13995 2/20 0.37
▸ PRMT5 O14744 4/20 0.36
▸ WDR77 Q9BQA1 3/20 0.36
▸ PIK3CA P42336 3/20 0.35
▸ MGLL Q99685 1/20 0.34
▸ ABHD6 Q9BV23 1/20 0.34
▸ FAAH O00519 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ MTHFD1 P11586 1/20 0.34
▸ MTOR P42345 2/20 0.33
▸ OGA O60502 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ FGFR4 P22455 1/20 0.33
▸ GPR6 P46095 1/20 0.33
▸ LCK P06239 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ HSP90B1 P14625 1/20 0.33
▸ TRAP1 Q12931 1/20 0.33

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
SCHEMBL29168681 1.00 PIP5K1C (0.39) PIP5K1CMTHFD2PRMT5WDR77PIK3CA
SCHEMBL29168685 1.00 PIP5K1C (0.39) PIP5K1CMTHFD2PRMT5WDR77PIK3CA
SCHEMBL31014015 0.93 PIP5K1C (0.38) PIP5K1CMTHFD2PIK3CAMGLLABHD6
SCHEMBL24913918 0.89 GPR119 (0.38) PIP5K1CPRMT5WDR77MGLLABHD6
SCHEMBL31014038 0.89 GPR119 (0.38) PIP5K1CPRMT5WDR77MGLLABHD6
SCHEMBL30156745 0.89 GPR119 (0.38) PIP5K1CPRMT5WDR77MGLLABHD6
SCHEMBL31013948 0.83 MGLL (0.40) PIP5K1CMGLLABHD6POLBTRAP1
SCHEMBL31014101 0.83 MGLL (0.40) PIP5K1CMGLLABHD6POLBTRAP1
SCHEMBL29168670 0.83 BRD4 (0.36) PRMT5WDR77OGAMAPK1FGFR4
SCHEMBL29168674 0.83 BRD4 (0.36) PRMT5WDR77OGAMAPK1FGFR4

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
EP-4651955-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2025-11-26 — — EP disclosed
WO-2024153947-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2024-07-25 — — WO disclosed
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