SCHEMBL4958641

SCHEMBL4958641

O=Cc1ccc(Cl)c(-c2ccccc2C(F)(F)F)c1OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
MRGPRX4 Q96LA9 2/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
LMNA P02545 1/20 0.35
FFAR1 O14842 2/20 0.35
AR P10275 2/20 0.35
ERN1 O75460 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
PPARG P37231 2/20 0.34
PPARA Q07869 2/20 0.34
USP1 O94782 2/20 0.34

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
SCHEMBL4962154 0.85 LMNA (0.39) RXRARXRBPOLBMAPTALOX5AP
SCHEMBL4958314 0.82 LMNA (0.39) POLBMRGPRX4ALOX5APFEN1LMNA
SCHEMBL4957705 0.82 THRA (0.45) RXRARXRBRXRGTHRATHRB
SCHEMBL6501237 0.79 MRGPRX4 (0.45) RXRARXRBRXRGPOLBMAPT
SCHEMBL4958287 0.77 KDM1A (0.40) RXRARXRBPOLBALOX5APFEN1
SCHEMBL4960000 0.76 HTR1A (0.42) RXRARXRBPOLBMRGPRX4LMNA
SCHEMBL6911539 0.76 CCNB2 (0.42) POLBMAPTTHRATHRBMRGPRX4
SCHEMBL4958324 0.75 STK10 (0.43) ERN1ALDH1A1
SCHEMBL4957592 0.74 ALDH1A1 (0.36) RXRARXRBRXRGMRGPRX4ALOX5AP
SCHEMBL4960882 0.72 LMNA (0.42) MRGPRX4ALOX5APFEN1LMNAAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1871759-A1 BENZODIOXANE AND BENZODIOXOLANE DERIVATIVES AND USES THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-01-02 EP disclosed
WO-2006116158-A1 BENZODIOXANE AND BENZODIOXOLANE DERIVATIVES AND USES THEREOF WYETH (US) 2006-11-02 WO disclosed
US-20060241172-A1 Benzodioxane and benzodioxolane derivatives and uses thereof WYETH (US) 2006-10-26 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-20060241172-A1 Benzodioxane and benzodioxolane derivatives and uses thereof HTR2C, HTR1D, HTR1A RXRA 315/4885RXRB 305/4885RXRG 355/4885

“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.