SCHEMBL7995219

SCHEMBL7995219

N#Cc1ccc(-c2nc(C(=O)O)c(-c3ccc(Cl)cc3)[nH]2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.48
MAPK14 Q16539 5/20 0.47
MAPK13 O15264 4/20 0.47
MAPK12 P53778 4/20 0.47
MAPK11 Q15759 4/20 0.47
RAF1 P04049 2/20 0.47
PIN1 Q13526 3/20 0.46
PARP1 P09874 2/20 0.46
CHEK2 O96017 4/20 0.45
IDO1 P14902 1/20 0.45
PRSS12 P56730 1/20 0.44
GCGR P47871 2/20 0.43
ALOX5 P09917 1/20 0.43
MAP2 P11137 1/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
NLRP3 Q96P20 1/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL7991943 0.87 MAPK14 (0.58) RHEBMAPK14MAPK13MAPK12MAPK11
SCHEMBL7989925 0.82 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL7991728 0.82 SIRT2 (0.53) RHEBPARP1GCGRALOX5LMNA
SCHEMBL7991890 0.80 BRAF (0.48) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL7995390 0.79 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL7977732 0.78 MAPT (0.56) MAPK14MAPK13MAPK12MAPK11PARP1
SCHEMBL7991619 0.77 MEN1 (0.50) MAPTTSHRHTTCYP1A2MAPK1
SCHEMBL7989686 0.76 PARP1 (0.48) MAPK14MAPK13MAPK12MAPK11PIN1
SCHEMBL7991843 0.76 AURKA (0.45) PARP1CHEK2LMNAMAPTHTT
SCHEMBL7977691 0.76 PRKAB2 (0.46) CHEK2GCGRMAPTCYP1A2CYP2C19

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-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed