SCHEMBL25596183

SCHEMBL25596183

C[C@H](c1ccc(O)cc1)[C@@](C)(N)CF

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.43
ESR2 Q92731 5/20 0.43
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
ALOX15 P16050 2/20 0.39
SLC6A2 P23975 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
PGR P06401 1/20 0.39
CHRM2 P08172 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
AR P10275 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
CHRM1 P11229 1/20 0.39
CYP2C9 P11712 1/20 0.39
DRD1 P21728 1/20 0.39
TBXA2R P21731 1/20 0.39

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
SCHEMBL25596200 0.81 ESR1 (0.41) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL9561475 0.78 ESR1 (0.52) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL25596210 0.78 ESR1 (0.52) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL11096673 0.76 BLM (0.42) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL22074749 0.76 BLM (0.42) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL22074748 0.76 BLM (0.42) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL25596185 0.74 BLM (0.40) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL14411802 0.73 ESR1 (0.56) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL8751432 0.73 ESR1 (0.56) ESR1ESR2PDCD1CD274ALOX15
SCHEMBL7899070 0.71 ESR1 (0.62) ESR1ESR2PDCD1CD274ALOX15

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-20230181493-A1 BIOMARKERS RELATED TO PARKINSON'S DISEASE AND METHODS OF USING THE SAME SENDA BIOSCIENCES INC (US) 2023-06-15 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-20230181493-A1 BIOMARKERS RELATED TO PARKINSON'S DISEASE AND METHODS OF USING THE SAME COMT, SNCA, PARK7 ESR1 4421/4885ESR2 4494/4885PDCD1 91/4885

“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.