SCHEMBL13812641

SCHEMBL13812641

CC(Cc1ccccc1)Oc1cccc(NC(=O)c2cc(Cl)ccc2O)c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 13/20 0.61
▸ TMPRSS4 Q9NRS4 6/20 0.60
▸ P2RX4 Q99571 3/20 0.59
▸ P2RX7 Q99572 3/20 0.59
▸ FADS1 O60427 3/20 0.55
▸ SLC2A1 P11166 1/20 0.52
▸ KCNMA1 Q12791 1/20 0.48

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
SCHEMBL13189706 0.86 P2RX1 (0.72) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL13189711 0.84 P2RX1 (0.65) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL3863657 0.82 P2RX1 (0.62) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL13812563 0.81 P2RX1 (0.59) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL13812642 0.81 P2RX1 (0.61) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL4270372 0.81 FADS1 (0.81) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL30771745 0.81 FADS1 (0.81) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL13189709 0.80 FADS1 (0.82) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL13812562 0.80 TMPRSS4 (0.62) P2RX1TMPRSS4P2RX4P2RX7FADS1
SCHEMBL13812633 0.79 P2RX1 (0.59) P2RX1TMPRSS4P2RX4P2RX7FADS1

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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