SCHEMBL24685226

SCHEMBL24685226

CC(=O)N(CC(F)F)c1ccc(-c2ccc(C(=O)NCCc3cccnc3)cn2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EIF4E P06730 1/20 0.47
▸ NPC1 O15118 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ NAMPT P43490 6/20 0.44
▸ PTAFR P25105 5/20 0.43
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ ATM Q13315 1/20 0.40
▸ P2RX7 Q99572 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
SCHEMBL30057801 1.00 EIF4E (0.47) EIF4ENPC1RAB9ASMN1; SMN2MEN1
SCHEMBL29801044 0.92 EIF4E (0.45) EIF4ENPC1SMN1; SMN2GAANAMPT
SCHEMBL24975327 0.92 EIF4E (0.45) EIF4ENPC1SMN1; SMN2GAANAMPT
SCHEMBL24685258 0.87 P2RX7 (0.46) P2RX7
SCHEMBL24685016 0.87 EIF4E (0.46) EIF4ENPC1RAB9ASMN1; SMN2MEN1
SCHEMBL24684923 0.86 NAMPT (0.43) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL24685246 0.85 EPHX2 (0.39) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL24976704 0.85 NPC1 (0.46) NPC1RAB9AGAANAMPT
SCHEMBL24684940 0.85 HPGDS (0.54) EIF4E
SCHEMBL24975189 0.85 LMNA (0.45) NPC1RAB9AGAAMAPT

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-2022241257-A1 NAMPT INHBITORS AND USES THEREOF REMEDY PLAN, INC. (US) 2022-11-17 — — WO disclosed
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