SCHEMBL6692440

SCHEMBL6692440

COC(=O)CNc1nc(F)c(Cl)c(Oc2ccc(OC)c(Br)c2)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 7/20 0.36
▸ RORC P51449 6/20 0.36
▸ ALDH1A1 P00352 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ NPBWR1 P48145 1/20 0.33
▸ THRA P10827 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL6689993 0.88 RORC (0.48) THRBRORCTHRA
SCHEMBL6689854 0.86 L3MBTL1 (0.39) THRBRORCLMNASMN1; SMN2L3MBTL1
SCHEMBL6697148 0.82 MAPK1 (0.37) THRBRORCALDH1A1LMNASMN1; SMN2
SCHEMBL6690029 0.81 THRB (0.43) THRBRORCTHRA
SCHEMBL6690024 0.81 SMN1; SMN2 (0.48) ALDH1A1LMNASMN1; SMN2L3MBTL1MEN1
SCHEMBL6692393 0.81 THRB (0.39) THRBRORCALDH1A1SMN1; SMN2MAPT
SCHEMBL6694174 0.80 THRB (0.45) THRBLMNASMN1; SMN2MAPTTHRA
SCHEMBL6693291 0.74 THRB (0.38) THRBALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL6693009 0.73 KDM4E (0.49) ALDH1A1LMNASMN1; SMN2MAPTKDM4E
SCHEMBL6693919 0.73 RORC (0.45) THRBRORCTHRA

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-6747048-B2 TREATING DISEASES OR DISORDERS ASSOCIATED WITH METABOLISM DYSFUNCTION OR WHICH ARE DEPENDENT UPON THE EXPRESSION OF A T3 REGULATED GENE, BRISTOL-MYERS SQUIBB COMPANY 2004-06-08 — — US disclosed
US-20040039028-A1 Pyridine-based thyroid receptor ligands BRISTOL-MYERS SQUIBB COMPANY 2004-02-26 — — US disclosed
WO-2003094845-A2 PYRIDINE-BASED THYROID RECEPTOR LIGANDS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-11-20 — — 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-20040039028-A1 Pyridine-based thyroid receptor ligands TSHR, THRB, THRA THRB 2/4885RORC 173/4885ALDH1A1 2058/4885

“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.

Send feedback