SCHEMBL13812710

SCHEMBL13812710

Cc1cc(C)c(OCCc2cccc(C(F)(F)F)c2)c(NC(=O)c2cc(Cl)ccc2O)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS4 Q9NRS4 11/20 0.52
▸ P2RX1 P51575 7/20 0.52
▸ P2RX4 Q99571 3/20 0.52
▸ P2RX7 Q99572 3/20 0.52
▸ SLC2A1 P11166 1/20 0.52
▸ MEN1 O00255 1/20 0.45
▸ IKBKB O14920 1/20 0.45
▸ CHUK O15111 1/20 0.45
▸ KDR P35968 1/20 0.45
▸ FLT3 P36888 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ MYLK Q15746 1/20 0.45
▸ MAP4K5 Q9Y4K4 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HSPH1 Q92598 1/20 0.43
▸ CNR1 P21554 1/20 0.41
▸ KCNMA1 Q12791 1/20 0.41

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
SCHEMBL13812645 0.87 MEN1 (0.49) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13812708 0.87 TMPRSS4 (0.53) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812831 0.87 TMPRSS4 (0.56) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812821 0.87 TMPRSS4 (0.55) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812709 0.86 TMPRSS4 (0.56) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812926 0.85 TMPRSS4 (0.53) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812823 0.84 TMPRSS4 (0.52) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812630 0.84 TMPRSS4 (0.58) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812682 0.83 TMPRSS4 (0.50) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812705 0.83 TMPRSS4 (0.61) TMPRSS4P2RX1P2RX4P2RX7SLC2A1

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
US-7547804-B2 Compounds, compositions, and methods employing same MYRIAD GENETICS, INC. (US) 2009-06-16 — — US disclosed
US-7547804-B2 Compounds, compositions, and methods employing same MYRIAD GENETICS, INC. (US) 2009-06-16 — — US disclosed
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