SCHEMBL25760144

SCHEMBL25760144

CC(=O)c1cc(C(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GAA P10253 4/20 0.42
LMNA P02545 2/20 0.42
RECQL P46063 1/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
GLRA3 O75311 1/20 0.42
GLRB P48167 1/20 0.42
ALOX5 P09917 2/20 0.41
PTGS1 P23219 2/20 0.41
PTGS2 P35354 2/20 0.41
GLRA1 P23415 1/20 0.40
CA2 P00918 3/20 0.39
CA1 P00915 2/20 0.39
CA5A P35218 1/20 0.39
ESRRA P11474 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL10554155 0.86 GLRA3 (0.50) GABRA1GABRB1SMN1; SMN2NPSR1GAA
SCHEMBL20099506 0.85 GABRA1 (0.42) GABRA1GABRB1SMN1; SMN2NPSR1GAA
SCHEMBL47718 0.83 SMN1; SMN2 (0.59) SMN1; SMN2NPSR1GAALMNARECQL
SCHEMBL2341096 0.83 GABRA1 (0.58) GABRA1GABRB1GAALMNAALDH1A1
SCHEMBL11699535 0.83 SMN1; SMN2 (0.43) GABRA1GABRB1SMN1; SMN2NPSR1GAA
SCHEMBL25760420 0.81 LMNA (0.42) GABRA1GABRB1SMN1; SMN2NPSR1GAA
Acetic Acid SCHEMBL1928603 0.80 GABRA1 (0.59) GABRA1GABRB1GAALMNAALDH1A1
Hydrochloric Acid SCHEMBL11652316 0.80 SMN1; SMN2 (0.55) SMN1; SMN2NPSR1GAALMNARECQL
Hydrochloric Acid SCHEMBL11652321 0.80 SMN1; SMN2 (0.55) SMN1; SMN2NPSR1GAALMNARECQL
SCHEMBL11611475 0.79 CA12 (0.49) GABRA1GABRB1SMN1; SMN2GAALMNA

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-11684590-B2 Substituted alkylphenols as HCN1 antagonists CORNELL UNIVERSITY (US) 2023-06-27 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-11684590-B2 Substituted alkylphenols as HCN1 antagonists HCN1, HCN2, HCN3 GABRA1 423/4885GABRB1 312/4885SMN1; SMN2 2718/4885

“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.