SCHEMBL30100456

SCHEMBL30100456

CN(C)c1ccc(CNc2ccc(NC(=O)c3cc(Cl)ccc3O)c(Cl)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ AURKA O14965 1/20 0.49
▸ PDPK1 O15530 1/20 0.49
▸ JAK2 O60674 1/20 0.49
▸ GMNN O75496 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ EGFR P00533 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ LYN P07948 1/20 0.49
▸ CHRM2 P08172 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ ADRA2A P08913 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49

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
SCHEMBL23675430 1.00 MEN1 (0.49) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL26096971 0.90 P2RX1 (0.59) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL26099973 0.88 MEN1 (0.54) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL23675410 0.86 KDM4C (0.57) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL30100505 0.86 KDM4C (0.57) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL23675418 0.86 P2RX1 (0.62) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL23675429 0.86 TMPRSS4 (0.57) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL30100434 0.86 TMPRSS4 (0.57) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL30100465 0.86 P2RX1 (0.56) MEN1NPC1MAPTMAPK1KMT2A
SCHEMBL23675409 0.86 P2RX1 (0.56) MEN1NPC1MAPTMAPK1KMT2A

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
EP-4093401-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING The Board of Regents of the University of Texas System (US) 2022-11-30 — — EP disclosed
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