SCHEMBL3130641

SCHEMBL3130641

COC(=O)C(F)Cc1cc(Br)c(Oc2ccc(NC(=O)CS(C)(=O)=O)c([N+](=O)[O-])c2)c(Br)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.43
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
PKM P14618 2/20 0.41
MAPT P10636 6/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 4/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
GAA P10253 2/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
HPGD P15428 1/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL3140729 0.89 MAPT (0.45) MAPK1MEN1KMT2APKMMAPT
SCHEMBL3137326 0.87 CA12 (0.38)
SCHEMBL3910682 0.86 LMNA (0.48) MAPK1MEN1KMT2APKMMAPT
SCHEMBL3131965 0.84 THRA (0.36) PKMMAPTSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL3910554 0.83 MEN1 (0.45) MAPK1MEN1KMT2APKMMAPT
SCHEMBL3911751 0.83 MAPT (0.50) MAPK1MEN1KMT2AMAPTNPC1
SCHEMBL3141253 0.82 ALDH1A1 (0.40) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL3911699 0.77 KMT2A (0.40) MAPK1MEN1KMT2AMAPTNPC1
SCHEMBL3910551 0.73 THRA (0.41)
SCHEMBL3907347 0.73 THRA (0.40) MEN1KMT2AMAPTALDH1A1CYP3A4

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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2010-01-07 US disclosed
EP-1899309-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2008-03-19 EP disclosed
WO-2007003419-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2007-01-11 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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR TSHR, GHSR, TRHR MAPK1 3627/4885MEN1 496/4885KMT2A 1184/4885

“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.