SCHEMBL1754877

SCHEMBL1754877

CCNCCCC(=O)Nc1cc(OC)ccc1OC

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.65
KMT2A Q03164 2/20 0.61
NPSR1 Q6W5P4 1/20 0.61
LMNA P02545 1/20 0.57
GAA P10253 4/20 0.56
ALDH1A1 P00352 3/20 0.55
CYP1A2 P05177 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
KDM4E B2RXH2 1/20 0.55
MAPK1 P28482 1/20 0.55
MEN1 O00255 1/20 0.53
TSHR P16473 1/20 0.53
TP53 P04637 1/20 0.52

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
SCHEMBL2097478 0.90 ALDH1A1 (0.66) KMT2AALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL17817424 0.84 GAA (0.76) POLBKMT2ANPSR1LMNAGAA
SCHEMBL8368156 0.84 GAA (0.76) POLBKMT2ANPSR1LMNAGAA
SCHEMBL8918895 0.84 KMT2A (0.71) POLBKMT2ANPSR1LMNAGAA
SCHEMBL9316115 0.83 POLB (0.69) POLBKMT2ANPSR1LMNAGAA
SCHEMBL6594370 0.81 KMT2A (0.75) POLBKMT2ANPSR1LMNAGAA
SCHEMBL6593284 0.80 KMT2A (0.69) POLBKMT2ANPSR1LMNAGAA
SCHEMBL3757797 0.79 KMT2A (0.73) POLBKMT2ANPSR1LMNAGAA
SCHEMBL2098191 0.79 NPC1 (0.63) NPSR1LMNAALDH1A1CYP1A2CYP2C19
SCHEMBL5807392 0.78 KMT2A (0.75) POLBKMT2ANPSR1LMNAGAA

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-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
EP-1831153-A2 COMPOUNDS DERIVED FROM LIDOCAINE, PHARMACEUTICAL COMPOSITIONS, USE AND METHOD OF TREATMENT, PREVENTION OR INHIBITION OF DISEASES FUNDA AO OSWALDO CRUZ-FIOCRUZ (BR) 2007-09-12 EP claimed
WO-2005120148-A2 COMPOUNDS DERIVED FROM LIDOCAINE, PHARMACEUTICAL COMPOSITIONS, USE AND METHOD OF TREATMENT, PREVENTION OR INHIBITION OF DISEASES FUNDAÇÃO OSWALDO CRUZ-FIOCRUZ (BR) 2005-12-22 WO 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 POLB 2684/4885KMT2A 3557/4885NPSR1 2702/4885

“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.