SCHEMBL5394642

SCHEMBL5394642

CC1C(=O)Nc2ccc(Oc3c(Cl)cc(C(=Cc4ccccc4)C(=O)O)cc3Cl)cc21

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
AKR1C1 Q04828 3/20 0.37
THRB P10828 4/20 0.35
THRA P10827 3/20 0.35
AKR1C3 P42330 4/20 0.34
AKR1C2 P52895 3/20 0.34
POLB P06746 1/20 0.33
BRD4 O60885 1/20 0.33
CDYL2 Q8N8U2 1/20 0.32
CDYL Q9Y232 1/20 0.32

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
SCHEMBL4354279 0.89 MEN1 (0.37) PGRMEN1KMT2AALDH1A1AKR1C1
SCHEMBL5398376 0.70 XIAP (0.44) MEN1KMT2AALDH1A1AKR1C1THRB
SCHEMBL5388975 0.69 THRB (0.65) MEN1KMT2AALDH1A1AKR1C1THRB
SCHEMBL5381969 0.68 THRB (0.59) MEN1KMT2AALDH1A1AKR1C1THRB
SCHEMBL5389009 0.68 THRA (0.39) PGRKMT2ATHRBTHRA
SCHEMBL7207954 0.64 PGR (0.48) PGRMEN1KMT2AALDH1A1POLB
SCHEMBL24112733 0.61 PGR (0.69) PGRMEN1KMT2APOLBCDYL2
SCHEMBL3290496 0.61 AKR1C1 (0.59) MEN1KMT2AALDH1A1AKR1C1AKR1C3
SCHEMBL3290499 0.61 AKR1C1 (0.59) MEN1KMT2AALDH1A1AKR1C1AKR1C3
SCHEMBL13744294 0.60 AKR1C2 (0.76) MEN1KMT2AALDH1A1AKR1C1AKR1C3

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-7199265-B2 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones KARO BIO AB (SE) 2007-04-03 US disclosed
US-20040097589-A1 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones KARO BIO AB (SE) 2004-05-20 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-20040097589-A1 Thyroid receptor ligands, pharmaceutical compositions comprising them and their use in the treatment of disorders influenced by thyroid hormones TSHR, THRA, THRB PGR 138/4885MEN1 386/4885KMT2A 4239/4885

“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.