SCHEMBL9312347

SCHEMBL9312347

COc1ccc(C2=NCCc3cc(O)ccc32)cc1OC

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 13/20 0.63
MAPK14 Q16539 3/20 0.58
MAPK9 P45984 2/20 0.58
MAPK8 P45983 1/20 0.58
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA7 P43166 2/20 0.55
CA9 Q16790 2/20 0.55
CA14 Q9ULX7 2/20 0.55
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL9311736 0.85 MAPK10 (0.61) MAPK10MAPK14MAPK9MAPK8ALDH1A1
SCHEMBL28180887 0.85 ALDH1A1 (0.76) MAPK10MAPK14MAPK9MAPK8ALDH1A1
SCHEMBL31011321 0.85 ALDH1A1 (0.76) MAPK10MAPK14MAPK9MAPK8ALDH1A1
Hydrochloric Acid SCHEMBL9312979 0.84 MAPK10 (0.60) MAPK10MAPK14MAPK9MAPK8ALDH1A1
SCHEMBL5353435 0.82 MAPK10 (0.60) MAPK10MAPK14MAPK9MAPK8ALDH1A1
Hydrochloric Acid SCHEMBL9311868 0.81 MAPK10 (0.59) MAPK10MAPK14MAPK9MAPK8ALDH1A1
SCHEMBL9312666 0.78 MAPT (0.53) MAPK10MAPK14MAPK9MAPK8ALDH1A1
SCHEMBL9848138 0.77 ALDH1A1 (0.54) MAPK10MAPK14MAPK9MAPK8ALDH1A1
SCHEMBL8483283 0.76 CA1 (0.65) MAPK10MAPK14MAPK9MAPK8ALDH1A1
SCHEMBL28931630 0.72 ALDH1A1 (0.79) MAPK10MAPK14MAPK9MAPK8ALDH1A1

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-RE34630-E Antagonist for platelet activating factor EUROCELTIQUE, S.A. (LU) 1994-06-07 US disclosed
EP-0422328-A2 Substituted isoquinolines and their use Euro-Celtique S.A. (LU) 1991-04-17 EP disclosed
US-4956371-A PLATELET ACTIVATING FACTOR EUROCELTIQUE, S.A. (LU) 1990-09-11 US disclosed