SCHEMBL6694244

SCHEMBL6694244

O=C(O)NCc1nc(F)c(Cl)c(Oc2ccc(O)c(S(=O)(=O)Nc3ccc(F)cc3)c2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.41
▸ HSD17B3 P37058 1/20 0.37
▸ HSD17B2 P37059 1/20 0.37
▸ LMNA P02545 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ IDH1 O75874 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ BCL2L1 Q07817 1/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ FFAR1 O14842 1/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.35
▸ PIK3CD O00329 1/20 0.35
▸ PIK3CG P48736 1/20 0.35
▸ PIK3C3 Q8NEB9 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ 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
SCHEMBL6699553 0.89 POLB (0.34) THRBHSD17B3HSD17B2L3MBTL1POLB
SCHEMBL6694671 0.83 L3MBTL1 (0.40) THRBLMNAALDH1A1SMN1; SMN2MCL1
SCHEMBL6693291 0.80 THRB (0.38) THRBHSD17B3HSD17B2LMNAALDH1A1
SCHEMBL6699438 0.76 L3MBTL1 (0.37) THRBLMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL6692377 0.76 LMNA (0.58) THRBLMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL4961522 0.74 THRB (0.55) THRBHSD17B3HSD17B2MAPT
SCHEMBL6690024 0.72 SMN1; SMN2 (0.48) LMNAALDH1A1HPGDSMN1; SMN2NPSR1
SCHEMBL6694254 0.72 CA12 (0.34) THRBHSD17B3HSD17B2LMNAALDH1A1
SCHEMBL6655902 0.72 THRB (0.51) THRBHSD17B3HSD17B2IDH1
SCHEMBL7513449 0.72 THRA (0.57) THRBIDH1

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 2 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

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 2/4885HSD17B3 702/4885HSD17B2 922/4885

“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.

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