SCHEMBL3908141

SCHEMBL3908141

COC(=O)CCc1cc(Br)c(Oc2ccc(N)c(N)c2)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 16/20 0.49
THRB P10828 16/20 0.49
NR4A1 P22736 1/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL3136292 0.88 THRA (0.46) THRATHRBMAPTKMT2A
SCHEMBL3131477 0.87 THRB (0.48) THRATHRBMAPTALDH1A1LMNA
SCHEMBL3908329 0.86 THRA (0.44) THRATHRBMAPTALDH1A1KMT2A
SCHEMBL3910714 0.85 KMT2A (0.46) THRATHRBMAPTALDH1A1LMNA
SCHEMBL3909957 0.85 KMT2A (0.46) THRATHRBMAPTALDH1A1LMNA
SCHEMBL3146055 0.85 THRA (0.48) THRATHRB
SCHEMBL3136070 0.81 THRA (0.45) THRATHRBMAPTALDH1A1LMNA
SCHEMBL14386131 0.81 THRA (0.42) THRATHRBMAPTALDH1A1LMNA
SCHEMBL3142103 0.80 THRB (0.44) THRATHRBMAPTALDH1A1LMNA
SCHEMBL3912492 0.79 SMN1; SMN2 (0.48) THRATHRBMAPTALDH1A1HTT

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-20090318514-A1 Novel Pharmaceutical Compositions KARO BIO AB (SE) 2009-12-24 US disclosed
EP-2024336-A1 NOVEL PHARMACEUTICAL COMPOSITIONS KARO BIO AB (SE) 2009-02-18 EP disclosed
WO-2007128492-A1 NOVEL PHARMACEUTICAL COMPOSITIONS KARO BIO AB (SE) 2007-11-15 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-20090318514-A1 Novel Pharmaceutical Compositions TSHR, TRHR, THRA THRA 3/4885THRB 5/4885NR4A1 148/4885

“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.