SCHEMBL13069746

SCHEMBL13069746

Cc1c(Cl)cccc1CCc1cccnc1F

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 6/20 0.39
KMT2A Q03164 3/20 0.39
BACE1 P56817 1/20 0.37
DPP4 P27487 1/20 0.36
DHODH Q02127 1/20 0.36
SGMS2 Q8NHU3 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TAAR1 Q96RJ0 1/20 0.35
SLC40A1 Q9NP59 1/20 0.35
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
RECQL P46063 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL3640846 0.73 GRM5 (0.45) TAAR1
SCHEMBL8094251 0.71 ALDH1A1 (0.45) P2RX7ALDH1A1TAAR1LMNAPOLB
SCHEMBL2140667 0.71 HSD11B1 (0.43)
SCHEMBL363908 0.70
SCHEMBL29751863 0.70
SCHEMBL5527194 0.70 TAAR1 (0.64) DPP4ALDH1A1TAAR1
SCHEMBL9871992 0.70 ALDH1A1 (0.43) P2RX7ALDH1A1TAAR1LMNA
SCHEMBL1290396 0.70 ALDH1A1 (0.43) P2RX7ALDH1A1TAAR1LMNA
SCHEMBL10519032 0.70 ALDH1A1 (0.43) P2RX7ALDH1A1TAAR1LMNA
SCHEMBL6963418 0.70 TAAR1 (0.54) DPP4TAAR1

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
EP-1888582-B1 IMIDAZO- AND TRIAZOLOPYRIDINES AS INHIBITORS OF 11-BETA HYDROXYSTEROID DEHYDROGENASE TYPE I BRISTOL MYERS SQUIBB CO (US) 2010-11-10 EP disclosed