SCHEMBL13812926

SCHEMBL13812926

Cc1ccc(OCCc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc(Cl)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS4 Q9NRS4 10/20 0.53
▸ P2RX1 P51575 6/20 0.53
▸ P2RX4 Q99571 3/20 0.53
▸ P2RX7 Q99572 3/20 0.53
▸ SLC2A1 P11166 1/20 0.53
▸ LMNA P02545 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ HTT P42858 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ NPY1R P25929 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ SIRT2 Q8IXJ6 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ IKBKB O14920 1/20 0.46
▸ CHUK O15111 1/20 0.46
▸ KDR P35968 1/20 0.46

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
SCHEMBL13812587 0.87 MAPT (0.56) TMPRSS4P2RX1LMNAMAPTHTT
SCHEMBL13812676 0.85 P2RX1 (0.69) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812710 0.85 TMPRSS4 (0.52) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812841 0.85 P2RX1 (0.53) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812823 0.85 TMPRSS4 (0.52) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812630 0.84 TMPRSS4 (0.58) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812708 0.84 TMPRSS4 (0.53) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812705 0.84 TMPRSS4 (0.61) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812709 0.83 TMPRSS4 (0.56) TMPRSS4P2RX1P2RX4P2RX7SLC2A1
SCHEMBL13812821 0.82 TMPRSS4 (0.55) 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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