SCHEMBL2903786

SCHEMBL2903786

CCCCCCCCCCCCS(=O)(=O)c1cc2c(cc1S(=O)(=O)CCCCCCCCCCCC)C(=O)c1c(c(O)c3cc(S(=O)(=O)CCCCCCCCCCCC)c(S(=O)(=O)CCCCCCCCCCCC)cc3c1O)C2=O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.40
PGAM1 P18669 1/20 0.36
EPHX2 P34913 1/20 0.36
SOAT1 P35610 9/20 0.36
THRA P10827 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
SCHEMBL2906943 0.91 KDM4E (0.43) THRBPGAM1EPHX2
SCHEMBL2904057 0.91 KDM4E (0.43) THRBPGAM1EPHX2
SCHEMBL12402099 0.89 THRB (0.40) THRBPGAM1EPHX2SOAT1THRA
SCHEMBL12402087 0.84 SERPINE1 (0.43) THRBEPHX2SOAT1THRA
SCHEMBL12402106 0.80 SERPINE1 (0.39) THRBEPHX2SOAT1THRA
SCHEMBL10908870 0.79 FAAH (0.45) THRBEPHX2SOAT1THRA
SCHEMBL10906676 0.79 FAAH (0.45) THRBEPHX2SOAT1THRA
SCHEMBL10908959 0.79 FAAH (0.45) THRBEPHX2SOAT1THRA
SCHEMBL10910576 0.79 FAAH (0.45) THRBEPHX2SOAT1THRA
SCHEMBL10908516 0.79 FAAH (0.45) THRBEPHX2SOAT1THRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9039946-B2 Reversibly thermochromic compositions BASF SE (DE) 2015-05-26 US disclosed
EP-1888705-B1 Reversibly thermochromic compositions BASF SE (DE) 2010-08-18 EP disclosed
US-20090302284-A1 Reversibly Thermochromic Compositions CIBA CORPORATION 2009-12-10 US disclosed
EP-1888705-A1 REVERSIBLY THERMOCHROMIC COMPOSITIONS Ciba Specialty Chemicals Holding, Inc. (CH) 2008-02-20 EP disclosed
WO-2006131465-A1 REVERSIBLY THERMOCHROMIC COMPOSITIONS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-12-14 WO 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-20090302284-A1 Reversibly Thermochromic Compositions DHCR7, NES, DUT THRB 2800/4885PGAM1 3060/4885EPHX2 1317/4885

“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.