SCHEMBL8501346

SCHEMBL8501346

CON=CC(=O)N(C)c1ccccc1COc1ncc(Cl)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ GPBAR1 Q8TDU6 1/20 0.36
▸ POLQ O75417 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TRPM8 Q7Z2W7 1/20 0.33
▸ MRGPRX4 Q96LA9 1/20 0.33
▸ SGMS2 Q8NHU3 2/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ LIPE Q05469 2/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL8642765 0.81 XPO1 (0.35) POLQALDH1A1ATMMEN1KMT2A
SCHEMBL8396125 0.81 RXRA (0.42) POLQATMMRGPRX4SGMS2EPHX2
SCHEMBL8648030 0.77 LIPE (0.45) MRGPRX4LIPESMN1; SMN2LMNA
SCHEMBL8398044 0.77 FFAR1 (0.42) MRGPRX4LIPEMAOAMAOB
SCHEMBL8395436 0.76 MCL1 (0.45) ALDH1A1MRGPRX4MAOB
SCHEMBL8399143 0.76 MAOB (0.39) MEN1KMT2AMAOAMAOBSMN1; SMN2
SCHEMBL8398978 0.76 MRGPRX4 (0.51) L3MBTL1ALDH1A1MRGPRX4GAASMN1; SMN2
SCHEMBL8645607 0.76 EPHX2 (0.34) POLQKMT2ASGMS2EPHX2MAOA
SCHEMBL8396086 0.75 TP53 (0.47) L3MBTL1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8396361 0.75 ANO1 (0.45) MRGPRX4POLB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5856573-A Process for producing 2-(2-hydroxymethylphenyl)acetamide derivative and intermediate for the production thereof SHIONOGI & CO., LTD (JP) 1999-01-05 — — US disclosed
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