SCHEMBL343281

SCHEMBL343281

NC(=O)c1cccc2c1C(=O)c1ccccc1CO2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.53
NFE2L2 Q16236 1/20 0.53
PARP1 P09874 5/20 0.49
MAPT P10636 5/20 0.47
ALDH1A1 P00352 4/20 0.47
RAB9A P51151 2/20 0.47
AURKA O14965 1/20 0.46
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
TP53 P04637 1/20 0.44
AKR1B1 P15121 1/20 0.44
KMT2A Q03164 1/20 0.41
MAPK14 Q16539 1/20 0.41
GRK6 P43250 1/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 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
SCHEMBL10460075 0.82 AKR1B1 (0.44) MAPTALDH1A1RAB9AMAOAMAOB
SCHEMBL7835016 0.79 ADORA2A (0.51) MAPTALDH1A1RAB9AMAOAMAOB
SCHEMBL11057750 0.75 AKR1B1 (0.57) MAPTALDH1A1RAB9AMAOAMAOB
SCHEMBL7833003 0.74 MAOA (0.59) MAPTALDH1A1RAB9AMAOAMAOB
SCHEMBL343377 0.74 ALDH1A1 (0.60) MAPTALDH1A1RAB9AMAOAMAOB
SCHEMBL10460076 0.74 KDM4E (0.48) MAPTALDH1A1RAB9AMAOAMAOB
SCHEMBL343740 0.74 MAOA (0.47) MAPTALDH1A1RAB9AMAOAMAOB
SCHEMBL7829487 0.73 KEAP1 (0.73) KEAP1NFE2L2MAPTALDH1A1GRK6
SCHEMBL7121384 0.73 KEAP1 (0.86) KEAP1NFE2L2MAPTALDH1A1MAOA
SCHEMBL86392 0.72 MAPT (0.67) MAPTALDH1A1RAB9AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2393797-B1 PROCESS FOR PREPARING OLOPATADINE AND/OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ZACH SYSTEM SPA (IT) 2016-04-20 EP disclosed
US-8835655-B2 Process for preparing olopatadine and/or a pharmaceutically acceptable salt thereof ZACH SYSTEM S.P.A (IT) 2014-09-16 US disclosed
US-20120016138-A1 PROCESS FOR PREPARING OLOPATADINE AND/OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ZACH SYSTEM S.P.A. (IT) 2012-01-19 US disclosed
EP-2393797-A2 PROCESS FOR PREPARING OLOPATADINE AND/OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ZaCh System S.p.A. (IT) 2011-12-14 EP disclosed
WO-2010089268-A2 PROCESS FOR PREPARING OLOPATADINE AND/OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ZACH SYSTEM S.P.A. (IT) 2010-08-12 WO 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-20120016138-A1 PROCESS FOR PREPARING OLOPATADINE AND/OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF QDPR, OPRD1, O60361 KEAP1 2727/4885NFE2L2 3323/4885PARP1 3165/4885

“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.