SCHEMBL30100465

SCHEMBL30100465

COc1ccc(CNc2ccc(NC(=O)c3cc(Cl)ccc3O)c(Cl)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 3/20 0.56
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ FADS1 O60427 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ AURKA O14965 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ PDPK1 O15530 1/20 0.49
▸ JAK2 O60674 1/20 0.49
▸ GMNN O75496 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

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
SCHEMBL23675409 1.00 P2RX1 (0.56) P2RX1MEN1KMT2AFADS1L3MBTL1
SCHEMBL26096971 0.90 P2RX1 (0.59) P2RX1MEN1KMT2AALDH1A1HTT
SCHEMBL26099973 0.88 MEN1 (0.54) P2RX1MEN1KMT2AALDH1A1HTT
SCHEMBL23675410 0.86 KDM4C (0.57) P2RX1MEN1KMT2AALDH1A1HTT
SCHEMBL30100505 0.86 KDM4C (0.57) P2RX1MEN1KMT2AALDH1A1HTT
SCHEMBL23675418 0.86 P2RX1 (0.62) P2RX1MEN1KMT2AALDH1A1HTT
SCHEMBL23675429 0.86 TMPRSS4 (0.57) P2RX1MEN1KMT2AALDH1A1HTT
SCHEMBL30100434 0.86 TMPRSS4 (0.57) P2RX1MEN1KMT2AALDH1A1HTT
SCHEMBL30100456 0.86 MEN1 (0.49) P2RX1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL23675430 0.86 MEN1 (0.49) P2RX1MEN1KMT2AL3MBTL1ALDH1A1

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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