SCHEMBL16627411

SCHEMBL16627411

CC(=O)/C=C/c1cccnc1Nc1ccc(O)cc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
LMNA P02545 3/20 0.47
MAPT P10636 3/20 0.47
GAA P10253 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALOX15 P16050 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
RUNX1 Q01196 1/20 0.47
CBFB Q13951 1/20 0.47
HSD17B10 Q99714 1/20 0.47
HPGD P15428 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 2/20 0.39
IAPP P10997 1/20 0.39
TNIK Q9UKE5 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 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
SCHEMBL16638724 0.87 ALDH1A1 (0.50) ALDH1A1LMNAMAPTGAAKDM4E
SCHEMBL16627419 0.87 RAB9A (0.61) ALDH1A1LMNAMAPTGAAHPGD
SCHEMBL16627410 0.87 ALDH1A1 (0.44) ALDH1A1LMNAMAPTKDM4EHPGD
SCHEMBL16627412 0.85 ADRA2A (0.44) ALDH1A1MAPTGAAKDM4EHPGD
SCHEMBL16627415 0.84 GAA (0.56) ALDH1A1LMNAMAPTGAAKDM4E
SCHEMBL16627417 0.83 MAPT (0.44) ALDH1A1LMNAMAPTGAAKDM4E
SCHEMBL16627388 0.81 MAPT (0.45) ALDH1A1LMNAMAPTGAAKDM4E
SCHEMBL16627422 0.79 ALDH1A1 (0.58) ALDH1A1LMNAMAPTGAAKDM4E
SCHEMBL16638725 0.75 ALDH1A1 (0.49) ALDH1A1LMNAMAPTGAAHPGD
SCHEMBL16638723 0.75 RAB9A (0.67) ALDH1A1LMNAMAPTGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9006451-B1 2-anilinonicotinyl based chalcones useful as potential anticancer agents and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-14 US disclosed
US-20150099888-A1 2-Anilinonicotinyl Based Chalcones Useful As Potential Anticancer Agents and Process for Preparation Thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-09 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-20150099888-A1 2-Anilinonicotinyl Based Chalcones Useful As Potential Anticancer Agents and Process for Preparation Thereof HCCS, WEE2, WEE1 ALDH1A1 1497/4885LMNA 1571/4885MAPT 2681/4885

“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.