SCHEMBL9707201

SCHEMBL9707201

Cc1ccc(OC(C)(C)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.52
ALDH1A1 P00352 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 2/20 0.40
ACHE P22303 2/20 0.40
LMNA P02545 1/20 0.40
ALOX12 P18054 1/20 0.40
KIF11 P52732 6/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.39
PPARG P37231 1/20 0.39
DRD2 P14416 2/20 0.37
DRD4 P21917 2/20 0.37
DRD3 P35462 2/20 0.37
RELA Q04206 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL21191439 0.98 MAPK1 (0.50) MAPK1ALDH1A1ALOX15TSHRACHE
SCHEMBL9332606 0.91 MAPK1 (0.61) MAPK1ALDH1A1ALOX15SMN1; SMN2PPARG
SCHEMBL23474359 0.89 TSHR (0.50) MAPK1ALDH1A1ALOX15TSHRACHE
SCHEMBL19928041 0.89 TSHR (0.50) MAPK1ALDH1A1ALOX15TSHRACHE
SCHEMBL19286607 0.87 MAPK1 (0.56) MAPK1ALDH1A1ALOX15TSHRKIF11
SCHEMBL9331411 0.87 MAPK1 (0.61) MAPK1ALDH1A1ALOX15TSHRSMN1; SMN2
SCHEMBL23474514 0.85 KIF11 (0.41) MAPK1ALDH1A1ALOX15TSHRACHE
SCHEMBL16406572 0.83 HTT (0.43) MAPK1ALDH1A1ALOX15TSHRACHE
SCHEMBL18405590 0.82 MAPK1 (0.50) MAPK1ALDH1A1ALOX15TSHRKIF11
SCHEMBL27210407 0.82 ESR1 (0.55) MAPK1ALDH1A1ALOX15TSHRLMNA

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-10766851-B1 Method to convert lignin 4-O-5 diaryl ethers and their model compounds into organic chemicals THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING / MCGILL UNIVERSITY (CA) 2020-09-08 US disclosed
EP-0486745-A1 Improved solvents for chromogens useful in the manufacture of carbonless copying paper MONSANTO EUROPE S.A./N.V. (BE) 1992-05-27 EP 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-10766851-B1 Method to convert lignin 4-O-5 diaryl ethers and their model compounds into organic chemicals PPOX, DAO, PAH MAPK1 4094/4885ALDH1A1 703/4885ALOX15 383/4885

“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.