SCHEMBL13812686

SCHEMBL13812686

Cc1cc(C)c(CCOc2ccc(C(F)(F)F)cc2NC(=O)c2cc(Cl)ccc2O)c(C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS4 Q9NRS4 11/20 0.59
▸ KDM4E B2RXH2 3/20 0.52
▸ HPGD P15428 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ P2RX1 P51575 5/20 0.50
▸ P2RX4 Q99571 3/20 0.50
▸ P2RX7 Q99572 3/20 0.50
▸ HTT P42858 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ SLC2A1 P11166 1/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ IKBKB O14920 1/20 0.47
▸ CHUK O15111 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ FLT3 P36888 1/20 0.47
▸ MYLK Q15746 1/20 0.47
▸ MAP4K5 Q9Y4K4 1/20 0.47
▸ KCNMA1 Q12791 3/20 0.45
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43

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
SCHEMBL13812628 0.91 KCNMA1 (0.53) TMPRSS4KDM4EALDH1A1P2RX1HTT
SCHEMBL13812538 0.86 TMPRSS4 (0.64) TMPRSS4KDM4EHPGDALDH1A1P2RX1
SCHEMBL13812711 0.86 TMPRSS4 (0.64) TMPRSS4KDM4EHPGDALDH1A1P2RX1
SCHEMBL13812649 0.84 TMPRSS4 (0.62) TMPRSS4KDM4EHPGDALDH1A1P2RX1
SCHEMBL13812832 0.84 TMPRSS4 (0.62) TMPRSS4KDM4EHPGDALDH1A1P2RX1
SCHEMBL13812850 0.84 TMPRSS4 (0.67) TMPRSS4KDM4EHPGDALDH1A1P2RX1
SCHEMBL13812705 0.83 TMPRSS4 (0.61) TMPRSS4KDM4EHPGDALDH1A1P2RX1
SCHEMBL13812829 0.83 TMPRSS4 (0.61) TMPRSS4KDM4EHPGDALDH1A1P2RX1
SCHEMBL13812886 0.83 TMPRSS4 (0.63) TMPRSS4KDM4EHPGDALDH1A1P2RX1
SCHEMBL13812889 0.83 TMPRSS4 (0.65) TMPRSS4KDM4EHPGDALDH1A1P2RX1

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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