SCHEMBL25723554

SCHEMBL25723554

Cc1cccc2c1OC(=O)C2c1ccccc1C(C)(C)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.32
KIF11 P52732 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL21889686 0.84 GAA (0.41) ALDH1A1GAAHPGDHTR2AHTR2C
SCHEMBL25723546 0.80 HPGD (0.41) ALDH1A1GAAHPGDHTR2AHTR2C
SCHEMBL2614948 0.77 GAA (0.53) ALDH1A1GAAHPGDHTR2B
SCHEMBL21889685 0.75 HTR2C (0.41) GAAHPGDHTR2AHTR2CHTR2B
SCHEMBL25723558 0.73 HTT (0.36) GAAHPGDHTR2AHTR2CHTR2B
SCHEMBL25723552 0.73 ALDH1A1 (0.43) ALDH1A1HPGD
SCHEMBL25723550 0.72 GAA (0.43) ALDH1A1GAAHPGD
SCHEMBL21889683 0.70 GAA (0.48) ALDH1A1GAAHPGD
SCHEMBL25723567 0.69 GAA (0.48) ALDH1A1GAA
SCHEMBL2612450 0.69 GAA (0.50) ALDH1A1GAAHTR2B

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-20230203353-A1 ADHESIVE FOR ENDOSCOPE AND CURED PRODUCT THEREOF, AND ENDOSCOPE AND METHOD FOR PRODUCING THE SAME FUJIFILM CORPORATION (JP) 2023-06-29 US disclosed
US-20230157720-A1 ENDOSCOPIC FLEXIBLE TUBE, ENDOSCOPIC MEDICAL APPARATUS, AND ENDOSCOPIC-FLEXIBLE-TUBE-BASE-COVERING MATERIAL FUJIFILM CORPORATION (JP) 2023-05-25 US disclosed