SCHEMBL3149305

SCHEMBL3149305

COCOc1ccc(Cc2c(C)cc(C(=O)OC)cc2C)cc1Cc1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
HSP90AA1 P07900 2/20 0.39
HSP90B1 P14625 1/20 0.39
MEN1 O00255 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 1/20 0.37
AR P10275 1/20 0.37
PTGER1 P34995 1/20 0.37
PLA2G2A P14555 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
EGFR P00533 1/20 0.36
GAA P10253 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
SCHEMBL282674 0.90 OPRK1 (0.43) L3MBTL1LMNAMAPTRAB9AHSP90AA1
SCHEMBL3158226 0.90 PPARA (0.41) PTGER1ALDH1A1EGFRGAAKDM5A
SCHEMBL3156007 0.87 THRA (0.39) ATMHSP90AA1HSP90B1PTGER1ALDH1A1
SCHEMBL3155899 0.85 OPRK1 (0.39) HSP90AA1HSP90B1PTGER1ALDH1A1GAA
SCHEMBL4213025 0.84 PTGER1 (0.35) RAB9AHSP90AA1HSP90B1MEN1KMT2A
SCHEMBL4207616 0.84 THRA (0.37) PTGER1ALDH1A1HPGDGAATHRA
SCHEMBL4202846 0.84 THRA (0.35) MAPTHSP90AA1HSP90B1KMT2APTGER1
SCHEMBL4961897 0.83 PTGER1 (0.33) PTGER1ALDH1A1HPGDSMN1; SMN2THRA
SCHEMBL4206031 0.82 PTGER1 (0.35) PTGER1ALDH1A1HPGDSMN1; SMN2GAA
SCHEMBL4349131 0.81 EGFR (0.42) PTGER1EGFRTHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100081634-A1 Novel Phosphorus-Containing Thyromimetics METABASIS THERAPEUTICS, INC. (US) 2010-04-01 US disclosed
US-7514419-B2 Phosphorus-containing thyromimetics METABASIS THERAPEUTICS, INC. (US) 2009-04-07 US disclosed
US-20090028925-A1 Novel Phosphinic Acid-Containing Thyromimetics METABASIS THERAPEUTICS, INC. 2009-01-29 US disclosed
CN-101189248-A Novel phosphorus-containing thyromimetics METABASIS THERAPEUTICS INC (US) 2008-05-28 CN disclosed
EP-1891080-A2 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS Metabasis Therapeutics, Inc. (US) 2008-02-27 EP disclosed
EP-1890768-A2 NOVEL PHOSPHINIC ACID-CONTAINING THYROMIMETICS Metabasis Therapeutics, Inc. (US) 2008-02-27 EP disclosed
WO-2006128056-A2 NOVEL PHOSPHINIC ACID-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS, INC. (US) 2006-11-30 WO disclosed
WO-2006128055-A2 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS, INC. (US) 2006-11-30 WO disclosed
US-20060046980-A1 Novel phosphorus-containing thyromimetics METABASIS THERAPEUTICS, INC. 2006-03-02 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 (3 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-20100081634-A1 Novel Phosphorus-Containing Thyromimetics PYGL, THRA, THOP1 ATM 1250/4885L3MBTL1 619/4885LMNA 3568/4885
US-20060046980-A1 Novel phosphorus-containing thyromimetics PYGL, THRA, THOP1 ATM 1250/4885L3MBTL1 619/4885LMNA 3568/4885
US-20090028925-A1 Novel Phosphinic Acid-Containing Thyromimetics PYGL, PHOSPHO1, LIPE ATM 1244/4885L3MBTL1 466/4885LMNA 4063/4885

“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.