SCHEMBL3135902

SCHEMBL3135902

CCn1c(C(=O)NC)nc2ccc(Oc3c(Br)cc(C(=O)NCC(=O)O)cc3Br)cc21

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 11/20 0.39
THRA P10827 2/20 0.38
THRB P10828 2/20 0.38
RAF1 P04049 2/20 0.37
BRAF P15056 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.36
EGLN1 Q9GZT9 2/20 0.36
HIF1A Q16665 2/20 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
SCHEMBL3137120 0.85 POLB (0.46) ACSS2THRATHRBRAF1BRAF
SCHEMBL3142267 0.84 THRA (0.41) ACSS2THRATHRBLMNA
SCHEMBL5137272 0.81 THRA (0.35) ACSS2THRATHRBRAF1BRAF
SCHEMBL3141209 0.76 THRB (0.46) THRATHRBEGLN1
SCHEMBL3140982 0.74 ACSS2 (0.37) ACSS2THRATHRBRAF1BRAF
SCHEMBL3138206 0.72 THRB (0.42) THRATHRBEGLN1HIF1A
SCHEMBL3137483 0.71 THRA (0.41) ACSS2THRATHRBLMNA
SCHEMBL3137491 0.71 THRA (0.41) ACSS2THRATHRBLMNA
SCHEMBL5137902 0.71 ACSS2 (0.35) ACSS2THRATHRBRAF1BRAF
SCHEMBL3137311 0.71 THRB (0.42) THRATHRBSMN1; SMN2EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2010-01-07 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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR TSHR, GHSR, TRHR ACSS2 519/4885THRA 4/4885THRB 6/4885

“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.