SCHEMBL6764946

SCHEMBL6764946

CONc1ccc(OC)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
TUBB1 Q9H4B7 4/20 0.46
ABCG2 Q9UNQ0 2/20 0.43
KCNQ3 O43525 1/20 0.43
KCNQ2 O43526 1/20 0.43
ABCB1 P08183 1/20 0.43
ABCC1 P33527 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM1A O60341 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
NAMPT P43490 1/20 0.42

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
SCHEMBL27563494 0.85 EPHX2 (0.39) LMNAMAPK1HTTRAB9ATUBB1
SCHEMBL3115364 0.82 TUBB1 (0.47) LMNAMAPK1HTTRAB9ATUBB1
SCHEMBL2000165 0.80 TUBB1 (0.46) LMNAMAPK1HTTRAB9ATUBB1
SCHEMBL20149559 0.80 TUBB1 (0.46) LMNAMAPK1HTTRAB9ATUBB1
SCHEMBL16104412 0.79 LMNA (0.46) LMNAMAPK1HTTRAB9ATUBB1
Hydrochloric Acid SCHEMBL2722417 0.78 TUBB1 (0.45) LMNAMAPK1HTTRAB9ATUBB1
Bromide SCHEMBL20984199 0.78 TUBB1 (0.45) LMNAMAPK1HTTRAB9ATUBB1
SCHEMBL2192767 0.78 ALDH1A1 (0.60) LMNAMAPK1HTTRAB9ASMN1; SMN2
SCHEMBL16411802 0.78 ABCG2 (0.46) LMNAMAPK1HTTRAB9AABCG2
SCHEMBL3926310 0.78 SMN1; SMN2 (0.54) LMNAMAPK1HTTRAB9ATUBB1

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-6710208-B2 REACTING AN N-ALKYLATED POLYMERIC HYDROXAMIC ACID RESIN WITH AN ORGANOMETALLIC REAGENT TO LIBERATE THE KETONE AVENTIS PHARMACEUTICALS INC. 2004-03-23 US disclosed
US-20020183558-A1 Process for the solid phase synthesis of aldehyde, ketone, oxime, amine, hydroxamic acid and alpha, beta-unsaturated carboxylic acid and aldehyde compounds AVENTIS PHARMACEUTICALS INC. 2002-12-05 US disclosed
US-6392010-B1 FLUOROPHENYL HYDROXYLAMINE RESIN AVENTIS PHARMACEUTICALS INC. 2002-05-21 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-20020183558-A1 Process for the solid phase synthesis of aldehyde, ketone, oxime, amine, hydroxamic acid and alpha, beta-unsaturated carboxylic acid and aldehyde compounds OGDH, OXGR1, ALDH7A1 LMNA 1802/4885MAPK1 1912/4885HTT 978/4885

“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.