SCHEMBL4568328

SCHEMBL4568328

CCOc1ccc2c(C(O)c3cccc(C(=O)OC)n3)c(-c3ccc(F)cc3)[nH]c2c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 2/20 0.38
MAPK12 P53778 2/20 0.38
MAPK11 Q15759 2/20 0.38
MAPK14 Q16539 2/20 0.38
CHRNA7 P36544 2/20 0.37
MAPT P10636 5/20 0.37
RXFP1 Q9HBX9 2/20 0.37
ALOX5 P09917 1/20 0.36
GCGR P47871 1/20 0.36
CNR1 P21554 1/20 0.36
TP53 P04637 2/20 0.36
POLB P06746 2/20 0.36
CYP19A1 P11511 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
GRM5 P41594 1/20 0.35
MAP2K4 P45985 1/20 0.35

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
SCHEMBL4568336 0.87 GRM5 (0.38) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL4568346 0.87 GRM5 (0.38) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL4568326 0.87 AXL (0.38) MAPTCNR1RAB9A
SCHEMBL4568329 0.87 KDM4E (0.41) MAPTRXFP1POLBCYP19A1GRM5
SCHEMBL4568332 0.82 CNR1 (0.41) MAPTCNR1TP53
SCHEMBL4568334 0.81 MAPT (0.39) MAPTCNR1TP53GRM5
SCHEMBL4568339 0.81 TUBB4A (0.41) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL4568518 0.81 CYP19A1 (0.42) MAPK13MAPK12MAPK11MAPK14CHRNA7
SCHEMBL4568338 0.79 MAPT (0.39) MAPTCNR1TP53NPC1GRM5
SCHEMBL4568335 0.77 TUBB4A (0.37) MAPTCNR1GRM5

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
EP-2474530-B1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL (JP) 2014-09-03 EP disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R MAPK13 3349/4885MAPK12 3318/4885MAPK11 1929/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.