SCHEMBL13812695

SCHEMBL13812695

Cc1ccc(OCCc2ccccc2C(F)(F)F)c(NC(=O)c2cc(Cl)ccc2O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 7/20 0.52
▸ TMPRSS4 Q9NRS4 9/20 0.51
▸ TP53 P04637 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ GAA P10253 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MRGPRX1 Q96LB2 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ GRM5 P41594 1/20 0.42
▸ SLC2A1 P11166 1/20 0.42
▸ P2RX1 P51575 1/20 0.42
▸ P2RX4 Q99571 1/20 0.42

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
SCHEMBL13812629 0.94 TMPRSS4 (0.55) KCNMA1TMPRSS4TP53MAPTGAA
SCHEMBL13812727 0.93 TMPRSS4 (0.51) KCNMA1TMPRSS4TP53MAPTRAB9A
SCHEMBL13812685 0.90 TMPRSS4 (0.65) KCNMA1TMPRSS4MEN1KMT2AKDM4E
SCHEMBL13812728 0.90 TMPRSS4 (0.50) KCNMA1TMPRSS4MAPTSMN1; SMN2GAA
SCHEMBL13812687 0.89 TMPRSS4 (0.50) KCNMA1TMPRSS4TP53MAPTRAB9A
SCHEMBL13812838 0.88 TMPRSS4 (0.55) KCNMA1TMPRSS4TP53MAPTGAA
SCHEMBL13812691 0.87 TMPRSS4 (0.48) KCNMA1TMPRSS4MEN1KMT2AMRGPRX1
SCHEMBL13812682 0.87 TMPRSS4 (0.50) KCNMA1TMPRSS4TP53MAPTRAB9A
SCHEMBL13812700 0.84 KCNMA1 (0.58) KCNMA1TMPRSS4TP53MAPTRAB9A
SCHEMBL13812730 0.84 TMPRSS4 (0.49) KCNMA1TMPRSS4TP53MAPTGAA

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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