SCHEMBL4887272

SCHEMBL4887272

Cc1ccc(C(O)(C(=O)O)c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.64
CYP2D6 P10635 1/20 0.55
HIF1A Q16665 1/20 0.55
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
HTT P42858 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 2/20 0.50
USP2 O75604 1/20 0.50
HPGD P15428 1/20 0.50
PAX8 Q06710 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
GAA P10253 2/20 0.46
KIF11 P52732 4/20 0.46
MAPT P10636 1/20 0.44
CYP1A2 P05177 1/20 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
SCHEMBL71815 0.94 CYP2C9 (0.61) CYP2C9CYP2D6HIF1AMEN1KMT2A
SCHEMBL4619076 0.91 CYP2C9 (0.55) CYP2C9CYP2D6HIF1AMEN1KMT2A
Bromomethane SCHEMBL3169377 0.89 CYP2C9 (0.57) CYP2C9CYP2D6HIF1AMEN1KMT2A
Benzylic Acid SCHEMBL7066 0.87 CYP2C9 (0.74) CYP2C9CYP2D6HIF1AKMT2AHTT
Benzylic Acid SCHEMBL4823051 0.85 CYP2C9 (0.65) CYP2C9CYP2D6HIF1AMEN1KMT2A
Benzylic Acid SCHEMBL1680669 0.84 CYP2C9 (0.71) CYP2C9CYP2D6HIF1AMEN1KMT2A
Benzylic Acid SCHEMBL9181980 0.84 CYP2C9 (0.71) CYP2C9CYP2D6HIF1AMEN1KMT2A
Benzylic Acid SCHEMBL20957595 0.84 CYP2C9 (0.71) CYP2C9CYP2D6HIF1AMEN1KMT2A
Benzylic Acid SCHEMBL1681667 0.84 CYP2C9 (0.71) CYP2C9CYP2D6HIF1AMEN1KMT2A
Benzylic Acid SCHEMBL868225 0.84 CYP2C9 (0.71) CYP2C9CYP2D6HIF1AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115108901-A Synthetic method of alpha-hydroxycarboxylic acid compound 四川大学 2022-09-27 CN disclosed
US-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-12-25 US disclosed
US-5776964-A HYPOTENSIVE AGENTS; ANTICHOLESTEROL AGENTS; CARDIOVASCULAR DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 1998-07-07 US disclosed
US-5521206-A HYPOTENSIVE AGENTS, TREATMENT OF ATHEROSCLEROSIS BAYER AKTIENGESELLSCHAFT (DE) 1996-05-28 US disclosed
US-5274104-A N-substituted heterocyclic derivatives useful in the treatment of cardiovascular disorders ELF SANOFI, A FRENCH CORP. (FR) 1993-12-28 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-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 CYP2C9 437/4885CYP2D6 136/4885HIF1A 4662/4885

“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.