SCHEMBL5767477

SCHEMBL5767477

Clc1ccc(Sc2ccc3nnc(-c4ccccc4Cl)n3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MAPK14 Q16539 6/20 0.43
LRRK2 Q5S007 1/20 0.42
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL5764736 0.93 HSD11B1 (0.44) HSD11B1ALDH1A1SMN1; SMN2LMNANPC1
SCHEMBL5764608 0.83 KMT2A (0.54) HSD11B1ALDH1A1SMN1; SMN2LMNAMAPK14
SCHEMBL5763351 0.82 MAPK14 (0.56) MAPK14
SCHEMBL5765041 0.81 KDM4E (0.54) HSD11B1ALDH1A1MAPK14LRRK2KDM4E
SCHEMBL5766027 0.78 MAPK14 (0.73) MAPK14
Hydrochloric Acid SCHEMBL4082863 0.78 MAPK14 (0.44) HSD11B1ALDH1A1SMN1; SMN2LMNANPC1
SCHEMBL5765439 0.77 MAPK14 (0.40) MAPK14LRRK2KDM4EKMT2AHSD17B10
SCHEMBL4072097 0.76 HSD11B1 (0.49) HSD11B1ALDH1A1SMN1; SMN2LMNANPC1
SCHEMBL15007237 0.76 HSD11B1 (0.52) HSD11B1ALDH1A1SMN1; SMN2LMNANPC1
SCHEMBL5766791 0.74 MAPK14 (0.47) MAPK14LRRK2KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7321040-B2 Triazolo-pyridines as anti-inflammatory compounds PFIZER INC. (US) 2008-01-22 US disclosed
US-7321040-B2 Triazolo-pyridines as anti-inflammatory compounds PFIZER INC. (US) 2008-01-22 US disclosed
EP-1601672-B1 TRIAZOLO-PYRIDINES AS ANTI-INFLAMMATORY COMPOUNDS PFIZER PROD INC (US) 2006-07-26 EP disclosed