SCHEMBL4922907

SCHEMBL4922907

CC(C)C(C)Nc1cc(Cl)cc(COc2c(Br)cc(C(=O)NCC(=O)O)cc2Br)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRA P10827 8/20 0.38
THRB P10828 8/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
GPR139 Q6DWJ6 3/20 0.37
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 2/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ITGB3 P05106 1/20 0.34
ITGA2B P08514 1/20 0.34
NPC1 O15118 1/20 0.33
PAX8 Q06710 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
DHODH Q02127 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL4929610 0.93 THRA (0.40) THRATHRBMEN1KMT2ASMN1; SMN2
SCHEMBL4932888 0.89 SMN1; SMN2 (0.39) THRATHRBMEN1KMT2ASMN1; SMN2
SCHEMBL4931530 0.86 SMN1; SMN2 (0.43) THRATHRBMEN1KMT2ASMN1; SMN2
SCHEMBL5110890 0.86 SENP5 (0.40) THRATHRBMEN1KMT2ASMN1; SMN2
SCHEMBL4354050 0.84 THRB (0.50) THRATHRBMEN1KMT2ASMN1; SMN2
SCHEMBL4525410 0.84 THRA (0.40) THRATHRBMEN1KMT2ASMN1; SMN2
SCHEMBL4523210 0.84 SMN1; SMN2 (0.40) THRATHRBMEN1KMT2ASMN1; SMN2
SCHEMBL4934497 0.83 HSD17B10 (0.39) MEN1KMT2ASMN1; SMN2GPR139LMNA
SCHEMBL4930987 0.82 THRB (0.41) THRATHRBMEN1KMT2ASMN1; SMN2
SCHEMBL5118417 0.82 SMN1; SMN2 (0.41) THRATHRBMEN1KMT2ASMN1; SMN2

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-20080221210-A1 Thyroid Receptor Agonists KARO BIO AB (SE) 2008-09-11 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-20080221210-A1 Thyroid Receptor Agonists TSHR, TRHR, THRA THRA 3/4885THRB 4/4885MEN1 773/4885

“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.