SCHEMBL13199332

SCHEMBL13199332

Cc1cc(C)c(C(F)(F)CO)cc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRB P28702 2/20 0.40
RXRA P19793 1/20 0.40
SORT1 Q99523 3/20 0.39
NOTUM Q6P988 3/20 0.38
PGK1 P00558 1/20 0.37
PGK2 P07205 1/20 0.37
HMGB1 P09429 1/20 0.35
CXCL12 P48061 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35
GABRA4 P48169 1/20 0.35
GABRE P78334 1/20 0.35

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
SCHEMBL15957876 0.93 RXRB (0.40) RXRBRXRASORT1NOTUMPGK1
SCHEMBL15957698 0.81 NOTUM (0.39) RXRBRXRASORT1NOTUMHMGB1
SCHEMBL15957608 0.79 PGK1 (0.39) PGK1PGK2
SCHEMBL13199192 0.77 RXRB (0.41) RXRBRXRASORT1NOTUMPGK1
SCHEMBL13199322 0.74 PGK1 (0.37) PGK1PGK2KDM4EALDH1A1HPGD
SCHEMBL15957644 0.73 CYP3A4 (0.43) PGK1PGK2KDM4EALDH1A1HSD17B10
SCHEMBL13199117 0.72 TAS2R14 (0.37) RXRBRXRANOTUMGABRPGABRD
SCHEMBL69934 0.72 KDM4E (0.50) RXRBRXRANOTUMHMGB1CXCL12
SCHEMBL7079991 0.71 RXRA (0.45) RXRBRXRASORT1NOTUMGABRP
SCHEMBL13199127 0.71 TPMT (0.38) KDM4EALDH1A1HSD17B10GAA

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
US-8809451-B2 Fluorinated dicarboxylic acid derivative and polymer obtained therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2014-08-19 US disclosed
US-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2011-12-08 US disclosed
WO-2010095678-A1 FLUORINATED DICARBOXYLIC ACID DERIVATIVE AND POLYMER OBTAINED THEREFROM セントラル硝子株式会社 (JP) 2010-08-26 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-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom MCCC2, AFF2, F13A1 RXRB 2616/4885RXRA 1270/4885SORT1 3074/4885

“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.