SCHEMBL13812592

SCHEMBL13812592

Cc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1OCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS4 Q9NRS4 7/20 0.55
▸ P2RX1 P51575 10/20 0.51
▸ P2RX4 Q99571 3/20 0.51
▸ P2RX7 Q99572 3/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ FADS1 O60427 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ HTR2A P28223 1/20 0.45
▸ HTR2C P28335 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ SLC2A1 P11166 1/20 0.45

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
SCHEMBL13812555 0.89 TMPRSS4 (0.54) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13812609 0.84 TMPRSS4 (0.64) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13812699 0.84 MEN1 (0.50) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13812704 0.83 MEN1 (0.49) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL3863657 0.82 P2RX1 (0.62) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13812627 0.82 MEN1 (0.55) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL3861646 0.82 KCNMA1 (0.56) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13812701 0.82 KCNMA1 (0.53) TMPRSS4P2RX1MEN1KMT2AALOX15
SCHEMBL13812598 0.82 KCNMA1 (0.51) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13812587 0.82 MAPT (0.56) TMPRSS4P2RX1MEN1KMT2AFADS1

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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