SCHEMBL246198

SCHEMBL246198

CC(C)OC(=O)Cc1cccc2c1C(=O)c1ccccc1CO2

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
AKR1B1 P15121 1/20 0.42
NPC1 O15118 2/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
ALOX12 P18054 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
AGTR1 P30556 1/20 0.39
KMT2A Q03164 1/20 0.38

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
SCHEMBL11217585 0.87 ALDH1A1 (0.47) ALDH1A1MAPTSMN1; SMN2AKR1B1NPC1
SCHEMBL11057750 0.82 AKR1B1 (0.57) ALDH1A1MAPTSMN1; SMN2AKR1B1RAB9A
SCHEMBL246663 0.80 HRH1 (0.56) ALDH1A1TSHRKDM4EKMT2A
SCHEMBL343740 0.79 MAOA (0.47) ALDH1A1MAPTSMN1; SMN2AKR1B1NPC1
SCHEMBL246197 0.77 ALDH1A1 (0.56) ALDH1A1MAPTSMN1; SMN2AKR1B1NPC1
SCHEMBL3359950 0.74 ALDH1A1 (0.49) ALDH1A1MAPTSMN1; SMN2AKR1B1NPC1
SCHEMBL10462625 0.72 AKR1B1 (0.51) ALDH1A1MAPTSMN1; SMN2AKR1B1KDM4E
SCHEMBL9870431 0.72 AKR1B1 (0.46) ALDH1A1MAPTSMN1; SMN2AKR1B1RAB9A
SCHEMBL10606255 0.71 MAPT (0.42) ALDH1A1MAPTSMN1; SMN2AKR1B1NPC1
SCHEMBL343377 0.71 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2AKR1B1NPC1

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
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
EP-2145882-A1 Process for obtaining olopatadine and intermediates Ragactives, S.L.U. (ES) 2010-01-20 EP 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 ALDH1A1 379/4885MAPT 3981/4885SMN1; SMN2 1959/4885

“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.