SCHEMBL243707

SCHEMBL243707

CN(C)C(=O)Cc1ccc2c(c1)C(=O)c1ccccc1CO2

nearest known ligand 0.86

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.60
ALDH1A1 P00352 2/20 0.58
MAPT P10636 2/20 0.58
RAB9A P51151 1/20 0.58
HRH1 P35367 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL9216642 0.93 AKR1B1 (0.58) AKR1B1ALDH1A1MAPTHRH1SMN1; SMN2
SCHEMBL9216257 0.88 AKR1B1 (0.56) AKR1B1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL9215390 0.88 AKR1B1 (0.56) AKR1B1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL12796661 0.87 ALDH1A1 (0.63) AKR1B1ALDH1A1MAPTRAB9ASMN1; SMN2
Isoxepac SCHEMBL29588437 0.86 AKR1B1 (0.81) AKR1B1ALDH1A1MAPTRAB9AHRH1
Isoxepac SCHEMBL24970 0.86 AKR1B1 (0.81) AKR1B1ALDH1A1MAPTRAB9AHRH1
SCHEMBL9219969 0.85 AKR1B1 (0.63) AKR1B1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL342988 0.85 AKR1B1 (0.63) AKR1B1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL11085181 0.84 ALDH1A1 (0.57) AKR1B1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL4008419 0.84 ALDH1A1 (0.60) AKR1B1ALDH1A1MAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120004426-A1 PROCESS FOR OBTAINING OLOPATADINE AND INTERMEDIATES RAGACTIVES, S.L.U. (ES) 2012-01-05 US claimed
EP-2145882-A1 Process for obtaining olopatadine and intermediates Ragactives, S.L.U. (ES) 2010-01-20 EP claimed
US-9000195-B2 Process for obtaining olopatadine and intermediates CRYSTAL PHARMA, S.A.U. (ES) 2015-04-07 US disclosed
US-9000195-B2 Process for obtaining olopatadine and intermediates CRYSTAL PHARMA, S.A.U. (ES) 2015-04-07 US disclosed
US-9000195-B2 Process for obtaining olopatadine and intermediates CRYSTAL PHARMA, S.A.U. (ES) 2015-04-07 US disclosed
EP-2666770-A1 Process for obtaining olopatadine and intermediates Crystal Pharma S.A.U (ES) 2013-11-27 EP disclosed
EP-2145882-B1 Process for obtaining olopatadine and intermediates CRYSTAL PHARMA SAU (ES) 2013-08-21 EP disclosed
US-20120004426-A1 PROCESS FOR OBTAINING OLOPATADINE AND INTERMEDIATES RAGACTIVES, S.L.U. (ES) 2012-01-05 US disclosed
US-20120004426-A1 PROCESS FOR OBTAINING OLOPATADINE AND INTERMEDIATES RAGACTIVES, S.L.U. (ES) 2012-01-05 US disclosed
US-20120004426-A1 PROCESS FOR OBTAINING OLOPATADINE AND INTERMEDIATES RAGACTIVES, S.L.U. (ES) 2012-01-05 US disclosed
WO-2010007056-A1 PROCESS FOR OBTAINING OLOPATADINE AND INTERMEDIATES RAGACTIVES, S.L.U. (ES) 2010-01-21 WO disclosed
EP-2145882-A1 Process for obtaining olopatadine and intermediates Ragactives, S.L.U. (ES) 2010-01-20 EP disclosed
US-4816591-A 6,11-dihydrodibenz[b,e]oxepin-acetic acids and derivatives AMERICAN HOECHST CORPORATION (US) 1989-03-28 US disclosed
US-4585788-A 6,11-dihydrodibenz[b,e]oxepin-acetic acids and derivatives AMERICAN HOECHST CORPORATION (US) 1986-04-29 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-20120004426-A1 PROCESS FOR OBTAINING OLOPATADINE AND INTERMEDIATES OXER1, AOC3, OPRD1 AKR1B1 329/4885ALDH1A1 379/4885MAPT 3981/4885

“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.