SCHEMBL2131186

SCHEMBL2131186

CCCCCCCCCCCCc1ccccc1OP(=O)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
PPARA Q07869 2/20 0.47
PPARG P37231 1/20 0.45
LIPG Q9Y5X9 1/20 0.43
ALOX5 P09917 1/20 0.42
PTGS2 P35354 1/20 0.42
TSHR P16473 1/20 0.42
BID P55957 1/20 0.40
BCL2L1 Q07817 1/20 0.40
MCL1 Q07820 1/20 0.40
BAK1 Q16611 1/20 0.40

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
SCHEMBL8151304 1.00 THRA (0.49) THRATHRBPPARAPPARGLIPG
SCHEMBL3919106 1.00 THRA (0.49) THRATHRBPPARAPPARGLIPG
SCHEMBL1548158 1.00 THRA (0.49) THRATHRBPPARAPPARGLIPG
SCHEMBL272120 0.94 THRA (0.42) THRATHRBPPARA
SCHEMBL30038205 0.94 THRA (0.42) THRATHRBPPARA
SCHEMBL1958087 0.94 THRA (0.42) THRATHRBPPARA
SCHEMBL30823682 0.94 THRA (0.42) THRATHRBPPARA
SCHEMBL10878267 0.93 THRA (0.55) THRATHRBPPARAPPARGLIPG
SCHEMBL9507916 0.93 THRA (0.55) THRATHRBPPARAPPARGLIPG
SCHEMBL4446002 0.93 THRA (0.55) THRATHRBPPARAPPARGLIPG

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
EP-2446005-B1 ANTI-WEAR AGENTS WITH A REDUCED NEUROTOXICITY NYCO (FR) 2015-04-29 EP disclosed
EP-2446005-A1 ANTI-WEAR AGENTS WITH A REDUCED NEUROTOXICITY Nyco SA (FR) 2012-05-02 EP disclosed
US-20120101015-A1 ANTI-WEAR AGENTS WITH A REDUCED NEUROTOXICITY NYCO SA (FR) 2012-04-26 US disclosed
WO-2010149690-A1 ANTI-WEAR AGENTS WITH A REDUCED NEUROTOXICITY NYCO SA (FR) 2010-12-29 WO disclosed
US-6093760-A LOW VOLATILITY FLAME RETARDANT FOR A STYRENE RESIN COMPRISING HYDROGEN OR HALOGEN OR HALOGEN-FREE 1-30 CARBON ATOMS SUBSTITUTED TRIPHENYLPHOSPHATE, WHERE THE SUBSTITUENTS IN EACH PHENYL ARE DIFFERENT ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2000-07-25 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-20120101015-A1 ANTI-WEAR AGENTS WITH A REDUCED NEUROTOXICITY SSB, PRNP, TARDBP THRA 660/4885THRB 2059/4885PPARA 678/4885

“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.