SCHEMBL19713095

SCHEMBL19713095

CC(C)c1ccccc1C(C=O)c1ccc(O)cc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.49
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
LMNA P02545 2/20 0.40
SLC6A2 P23975 2/20 0.40
HTR2B P41595 2/20 0.40
TRPA1 O75762 1/20 0.40
CHRM1 P11229 1/20 0.40
ADRA1A P35348 1/20 0.40
ANPEP P15144 1/20 0.38
DPP4 P27487 1/20 0.38
GAA P10253 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
FAAH O00519 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL19713102 1.00 TYR (0.49) TYRGABRA1GABRB2LMNASLC6A2
SCHEMBL2174674 0.82 NR1H4 (0.45) TYRGAACA1CA2TSHR
SCHEMBL4686426 0.79 TYR (0.57) TYRGAAMGAMSIMGAM2
SCHEMBL383417 0.75 LMNA (0.64) TYRGABRA1GABRB2LMNASLC6A2
SCHEMBL29446964 0.75 LMNA (0.64) TYRGABRA1GABRB2LMNASLC6A2
SCHEMBL2827168 0.75 TYR (0.43) TYRHPGDALDH1A1
SCHEMBL27536513 0.74 TYR (0.50) TYRLMNASLC6A2HTR2BTRPA1
SCHEMBL14855983 0.74 TYR (0.47) TYRLMNAHTR2BADRA1ATSHR
SCHEMBL5204089 0.73 TYR (0.42) TYRLMNASLC6A2HTR2BTRPA1
SCHEMBL20681680 0.73 NQO1 (0.40) TYRSLC6A2CYP1A2CYP3A4ALDH1A1

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-20170362210-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2017-12-21 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-20170362210-A1 ANTI-ESTROGENIC COMPOUNDS ESR1, ESRRA, ESR2 TYR 1385/4885GABRA1 2423/4885GABRB2 2760/4885

“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.