SCHEMBL3974398

SCHEMBL3974398

COc1ccc(C=NNC(=O)C2CC2c2ccc(Cl)cc2)cc1OC

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TRPM5 Q9NZQ8 9/20 0.80
▸ ALDH1A1 P00352 3/20 0.57
▸ HPGD P15428 2/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ KDM4E B2RXH2 3/20 0.51
▸ LMNA P02545 2/20 0.51
▸ GAA P10253 1/20 0.51
▸ MAPT P10636 1/20 0.51

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
SCHEMBL14417616 1.00 TRPM5 (0.80) TRPM5ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL1223594 0.89 TRPM5 (1.00) TRPM5ALDH1A1KDM4ELMNAGAA
SCHEMBL3862190 0.89 TRPM5 (1.00) TRPM5ALDH1A1KDM4ELMNAGAA
SCHEMBL1223595 0.89 TRPM5 (1.00) TRPM5ALDH1A1KDM4ELMNAGAA
SCHEMBL12881201 0.83 TRPM5 (0.81) TRPM5ALDH1A1KDM4ELMNAGAA
SCHEMBL1225193 0.80 TRPM5 (1.00) TRPM5ALDH1A1KDM4ELMNAGAA
SCHEMBL1225191 0.80 TRPM5 (1.00) TRPM5ALDH1A1KDM4ELMNAGAA
SCHEMBL1225192 0.80 TRPM5 (1.00) TRPM5ALDH1A1KDM4ELMNAGAA
SCHEMBL2782478 0.80 TRPM5 (1.00) TRPM5ALDH1A1KDM4ELMNAGAA
SCHEMBL1225195 0.80 TRPM5 (1.00) TRPM5ALDH1A1KDM4ELMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1951215-A4 HYDRAZONE DERIVATIVES AND USES THEREOF REDPOINT BIO CORP (US) 2009-07-29 — — EP disclosed
US-7501425-B1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyprimidines as inhibitors of cellular proliferation WARNER LAMBERT COMPANY (US) 2009-03-10 — — US disclosed
EP-1951215-A2 HYDRAZONE DERIVATIVES AND USES THEREOF Redpoint Bio Corporation (US) 2008-08-06 — — EP disclosed
EP-1080092-B1 BICYCLIC PYRIMIDINES AND BICYCLIC 3,4-DIHYDROPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2008-07-23 — — EP disclosed
US-20070207093-A1 Hydrazone derivatives and uses thereof LINQUAGEN CORP. 2007-09-06 — — US disclosed
EP-1801112-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation Warner-Lambert Company LLC (US) 2007-06-27 — — EP disclosed
WO-2007056159-A2 HYDRAZONE DERIVATIVES AND USES THEREOF REDPOINT BIO CORPORATION (US) 2007-05-18 — — WO disclosed
US-20040044012-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation DOBRUSIN ELLEN MYRA (US) 2004-03-04 — — 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 (2 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-20040044012-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation CCNI, CCNH, CCNA1 TRPM5 2071/4885ALDH1A1 2575/4885HPGD 594/4885
US-20070207093-A1 Hydrazone derivatives and uses thereof TAS2R1, TAS2R5, TAS1R1 TRPM5 49/4885ALDH1A1 72/4885HPGD 357/4885

“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.

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