SCHEMBL2097478

SCHEMBL2097478

CCNCCCC(=O)Nc1ccc(OC)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.66
MAPT P10636 1/20 0.64
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62
HPGD P15428 1/20 0.59
L3MBTL1 Q9Y468 3/20 0.58
TP53 P04637 2/20 0.56
TSHR P16473 1/20 0.56
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
KMT2A Q03164 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL1754877 0.90 POLB (0.65) ALDH1A1L3MBTL1TP53TSHRCYP1A2
SCHEMBL8708567 0.84 ALDH1A1 (0.69) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL6001770 0.81 ALDH1A1 (0.77) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL6001774 0.81 ALDH1A1 (0.77) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL10852085 0.81 ALDH1A1 (0.82) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL1494291 0.79 ALDH1A1 (0.79) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL1063240 0.79 HDAC3 (0.74) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL2092853 0.78 ALDH1A1 (0.82) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL2092856 0.78 ALDH1A1 (0.82) ALDH1A1MAPTNPC1RAB9AHPGD
SCHEMBL7370090 0.78 ALDH1A1 (0.63) ALDH1A1MAPTNPC1RAB9AHPGD

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-20080221206-A1 Compounds Derived From Lidocaine, Pharmaceutical Compositions, Use And Method Of Treatment, Prevention Or Inhibition Of Disease FUNDÇÃO OSWALDO CRUZ-FIOCRUZ (BR) 2008-09-11 US claimed
US-8163803-B2 less anesthetic activity, but with more anti-inflammatory and spasmolytic activity; asthma, rhinitis, allergic urticaria, chronic lung inflammation associated with eosinophilia, following the example of atopic asthma and chronic intestinal inflammation, as colitis for instance Fundação Oswaldo Cruz—FIOCRUZ (BR) 2012-04-24 US disclosed
US-20080221206-A1 Compounds Derived From Lidocaine, Pharmaceutical Compositions, Use And Method Of Treatment, Prevention Or Inhibition Of Disease FUNDÇÃO OSWALDO CRUZ-FIOCRUZ (BR) 2008-09-11 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-20080221206-A1 Compounds Derived From Lidocaine, Pharmaceutical Compositions, Use And Method Of Treatment, Prevention Or Inhibition Of Disease LTA, LCT, LTC4S ALDH1A1 1601/4885MAPT 389/4885NPC1 1548/4885

“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.