SCHEMBL30100514

SCHEMBL30100514

O=C(Nc1ccc(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1Cl)c1cc(Cl)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMPRSS4 Q9NRS4 14/20 0.64
P2RX1 P51575 9/20 0.64
P2RX4 Q99571 5/20 0.61
P2RX7 Q99572 5/20 0.61
MEN1 O00255 2/20 0.61
KDR P35968 2/20 0.61
KMT2A Q03164 2/20 0.61
IKBKB O14920 1/20 0.61
CHUK O15111 1/20 0.61
FLT3 P36888 1/20 0.61
MYLK Q15746 1/20 0.61
MAP4K5 Q9Y4K4 1/20 0.61
SLC2A1 P11166 1/20 0.53
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
ALDH1A1 P00352 1/20 0.49
EGFR P00533 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
SCHEMBL23675454 1.00 TMPRSS4 (0.64) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL23675416 0.96 TMPRSS4 (0.59) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL26096505 0.94 TMPRSS4 (0.57) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL23675397 0.92 TMPRSS4 (0.65) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL30100476 0.92 TMPRSS4 (0.65) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL23675407 0.91 TMPRSS4 (0.61) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL30100480 0.91 TMPRSS4 (0.61) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL26099711 0.87 P2RX1 (0.56) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL26096971 0.86 P2RX1 (0.59) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL26099410 0.84 P2RX1 (0.54) TMPRSS4P2RX1P2RX4P2RX7MEN1

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