SCHEMBL13812645

SCHEMBL13812645

Cc1cc(C)c(OCCc2ccccc2)c(NC(=O)c2cc(Cl)ccc2O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ P2RX1 P51575 3/20 0.49
▸ TMPRSS4 Q9NRS4 2/20 0.49
▸ KCNMA1 Q12791 8/20 0.47
▸ MAPT P10636 2/20 0.45
▸ ALOX15 P16050 2/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ NPY1R P25929 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ NPY2R P49146 1/20 0.45
▸ RAB9A P51151 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
SCHEMBL13812710 0.87 TMPRSS4 (0.52) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL13812700 0.85 KCNMA1 (0.58) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL13812682 0.84 TMPRSS4 (0.50) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL13812587 0.83 MAPT (0.56) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL13812701 0.83 KCNMA1 (0.53) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL13812706 0.82 MEN1 (0.52) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL13812704 0.82 MEN1 (0.49) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL3861646 0.81 KCNMA1 (0.56) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL13812627 0.81 MEN1 (0.55) MEN1KMT2AP2RX1TMPRSS4KCNMA1
SCHEMBL13812598 0.81 KCNMA1 (0.51) MEN1KMT2AP2RX1TMPRSS4KCNMA1

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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