SCHEMBL6769847

SCHEMBL6769847

COCOc1ccc(C(=O)O)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.51
RARA P10276 1/20 0.49
RARB P10826 1/20 0.49
MAOA P21397 1/20 0.49
PARP10 Q53GL7 4/20 0.45
PARP14 Q460N5 1/20 0.45
CPS1 P31327 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
DHODH Q02127 2/20 0.43
PARP15 Q460N3 2/20 0.43

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
SCHEMBL6767799 0.87 MAOB (0.62) MAOBMAOAPARP10PARP14CPS1
SCHEMBL2330110 0.87 MCL1 (0.44) MRGPRX4
SCHEMBL5838811 0.85 ALDH1A1 (0.56)
SCHEMBL13366264 0.83 RARA (0.55) MAOBRARARARBMAOACPS1
SCHEMBL18793210 0.81 MAOB (0.51) MAOBRARARARBMAOAPARP10
SCHEMBL1051747 0.81 CPS1 (0.63) CPS1
SCHEMBL7825340 0.81 RARB (0.71) MAOBRARARARB
SCHEMBL8128200 0.81 MAOB (0.44) MAOBMAOAPARP10PARP14CPS1
SCHEMBL3874777 0.81 RARA (0.63) MAOBRARARARBMAOAMRGPRX4
SCHEMBL4279588 0.79 MAOB (0.50) MAOBRARARARBMAOA

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 MAOB 317/4885RARA 125/4885RARB 240/4885

“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.