SCHEMBL9688908

SCHEMBL9688908

Cc1ccc(CC(N)=O)c(C)c1OC(F)F

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ATM Q13315 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SCN5A Q14524 1/20 0.32
▸ PTGER4 P35408 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ RAB9A P51151 1/20 0.30
▸ ICMT O60725 1/20 0.30

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
SCHEMBL7120045 0.75 HTT (0.38) HTTALDH1A1ICMT
SCHEMBL13980116 0.72 MEN1 (0.33) MEN1ALDH1A1MAPTKMT2ASCN5A
SCHEMBL2531130 0.71 ALDH1A1 (0.40) HTTMEN1ALDH1A1MAPTKMT2A
SCHEMBL8680142 0.70 HTT (0.33) ATMHTTMEN1ALDH1A1MAPT
SCHEMBL12433432 0.70 MEN1 (0.36) ATMLMNAMEN1ALDH1A1MAPT
SCHEMBL31484258 0.69 GRIN2D (0.33) HTTALDH1A1ICMT
SCHEMBL29718486 0.68 L3MBTL1 (0.43) L3MBTL1LMNAHTTMEN1ALDH1A1
SCHEMBL8679249 0.68 HTT (0.32) ATMHTTRAB9A
SCHEMBL25527063 0.68 MEN1 (0.33) LMNAMEN1ALDH1A1MAPTKMT2A
SCHEMBL12569788 0.67 IRAK4 (0.44) L3MBTL1ATMLMNAHTTALDH1A1

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
EP-0201575-B1 NEW PICOLINE DERIVATIVES, PREPARATION PROCESS THEREOF, UTILIZATION THEREOF AND DRUGS CONTAINING THEM Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1992-08-12 — — EP disclosed
US-4686230-A Picoline derivative useful as gastric acid secretion inhibitors BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1987-08-11 — — US disclosed
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