SCHEMBL26304580

SCHEMBL26304580

Cc1cccc2c1OC(C)(C)C(C)(C)O2

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
HTR2C P28335 2/20 0.33
CD44 P16070 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2A6 P11509 1/20 0.33
ALDH1A1 P00352 3/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
TSHR P16473 1/20 0.32
ACHE P22303 1/20 0.32
MAP3K14 Q99558 1/20 0.32
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 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
SCHEMBL10522329 0.83 ALDH1A1 (0.46) HTR2CCD44CYP1A2CYP2A6ALDH1A1
SCHEMBL25121118 0.79 CD44 (0.35) HPGDLMNAHTR2CCD44CYP1A2
SCHEMBL14547572 0.79 HTR2C (0.32) HTR2CCD44CYP1A2CYP2A6ALDH1A1
SCHEMBL9776180 0.78 CNR1 (0.32) HPGDHTR2CCD44CYP1A2CYP2A6
SCHEMBL7267859 0.77 MAP3K14 (0.34) HTR2CCD44CYP1A2CYP2A6ALDH1A1
SCHEMBL7693244 0.77 HTR2C (0.33) HTR2CCD44CYP1A2CYP2A6ALDH1A1
SCHEMBL423294 0.77 ADORA2A (0.35) HTR2CCD44CYP1A2CYP2A6CA1
SCHEMBL21009663 0.77 MAP3K14 (0.34) HTR2CCD44CYP1A2CYP2A6ALDH1A1
SCHEMBL4235163 0.76 ALDH1A1 (0.33) HTR2CALDH1A1
SCHEMBL9058839 0.76 HTR2C (0.30) HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295154-A1 HETEROCYCLIC GLP-1 AGONISTS SHOUTI INC. 2023-09-21 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-20230295154-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, GCGR HPGD 919/4885LMNA 3670/4885HTR2C 160/4885

“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.