SCHEMBL6380247

SCHEMBL6380247

COc1ccc(C=C(C(=O)O)C(=O)O)cc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.62
AOX1 Q06278 1/20 0.62
MAPT P10636 2/20 0.58
TUBB1 Q9H4B7 10/20 0.57
TUBB4A P04350 3/20 0.57
TUBB P07437 3/20 0.57
TUBA3C P0DPH7 3/20 0.57
TUBA1B P68363 3/20 0.57
TUBA4A P68366 3/20 0.57
TUBB4B P68371 3/20 0.57
TUBB3 Q13509 3/20 0.57
TUBB2A Q13885 3/20 0.57
TUBB8 Q3ZCM7 3/20 0.57
TUBA3E Q6PEY2 3/20 0.57
TUBA1A Q71U36 3/20 0.57
TUBA1C Q9BQE3 3/20 0.57
TUBB6 Q9BUF5 3/20 0.57
TUBB2B Q9BVA1 3/20 0.57
GAA P10253 1/20 0.57
TDP1 Q9NUW8 1/20 0.57

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
SCHEMBL7581752 0.87 GLO1 (0.69) ALDH1A1MAPTTUBB1TUBB4ATUBB
SCHEMBL23270371 0.87 ALDH1A1 (0.62) ALDH1A1AOX1MAPTTUBB1TUBB4A
SCHEMBL2213640 0.87 MAPT (0.77) ALDH1A1MAPTGAATDP1AKT1
SCHEMBL28552784 0.87 MAPT (0.77) ALDH1A1AOX1MAPTTUBB1TUBB4A
SCHEMBL2225902 0.86 GAA (0.75) ALDH1A1MAPTGAATDP1CYP1A2
SCHEMBL6380063 0.85 ALDH1A1 (0.60) ALDH1A1AOX1MAPTTUBB1TUBB4A
SCHEMBL31606907 0.84 TUBB1 (0.67) ALDH1A1AOX1MAPTTUBB1TUBB4A
SCHEMBL7813363 0.83 GAA (0.75) ALDH1A1MAPTGAATDP1CYP1A2
SCHEMBL7813366 0.83 GAA (0.75) ALDH1A1MAPTGAATDP1CYP1A2
SCHEMBL11466495 0.82 TUBB1 (0.48) ALDH1A1AOX1MAPTTUBB1TUBB4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050032787-A1 Pheny (alkyl)carboxylic acid derivatives and dionic phenylalkylheterocyclic derivatives and their use as medicines with serum glucose and/or serum lipid lowering activity SIGMA-TAU INDUSTRIES FARMACEUTICHE RIUNITE S.P.A. (IT) 2005-02-10 US disclosed
US-20030212100-A1 Quinoline derivatives and medicinal use thereof MITSUI CHEMICALS, INC. (JP) 2003-11-13 US disclosed
EP-1266888-A1 QUINOLINE DERIVATIVES AND MEDICINAL USE THEREOF Mitsui Chemicals, Inc. (JP) 2002-12-18 EP disclosed
US-4153713-A NEUROPSYCHOTROPIC AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1979-05-08 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-20030212100-A1 Quinoline derivatives and medicinal use thereof PPARG, PPARD, PPARA ALDH1A1 822/4885AOX1 1899/4885MAPT 2433/4885
US-20050032787-A1 Pheny (alkyl)carboxylic acid derivatives and dionic phenylalkylheterocyclic derivatives and their use as medicines with serum glucose and/or serum lipid lowering activity LIPC, CPT1A, GPR119 ALDH1A1 1194/4885AOX1 2104/4885MAPT 3652/4885

“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.