SCHEMBL7034817

SCHEMBL7034817

CCOc1ccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(C(=O)O)c2)cc1.[LiH]

nearest known ligand 0.80

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.80
PPARA Q07869 4/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
POLB P06746 1/20 0.57
TP53 P04637 2/20 0.55
TAS1R3 Q7RTX0 1/20 0.51
TAS1R1 Q7RTX1 1/20 0.51
ALDH1A1 P00352 2/20 0.51
NPC1 O15118 2/20 0.51
KDM4E B2RXH2 1/20 0.51
HDAC1 Q13547 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL7040832 0.99 PPARG (0.81) PPARGPPARAMEN1KMT2APOLB
SCHEMBL7034829 0.90 PPARG (0.80) PPARGPPARAMEN1KMT2APOLB
Lithium Ion SCHEMBL7034813 0.89 PPARG (1.00) PPARGPPARAMEN1KMT2APOLB
SCHEMBL7041193 0.87 PPARG (0.66) PPARGPPARAMEN1KMT2ANPC1
SCHEMBL7036809 0.85 PPARG (0.67) PPARGPPARAMEN1KMT2ANPC1
SCHEMBL7038560 0.83 PPARG (0.62) PPARGPPARAMEN1KMT2APOLB
SCHEMBL7039328 0.83 PPARG (0.68) PPARGPPARAMEN1KMT2APOLB
SCHEMBL7041703 0.83 PPARG (0.58) PPARGPPARAMEN1KMT2ATP53
SCHEMBL7042167 0.82 PPARG (0.63) PPARGPPARAMEN1KMT2APOLB
SCHEMBL7151918 0.82 PPARG (0.57) PPARGPPARAMEN1KMT2ATP53

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-20030073862-A1 Compounds BIOVITRUM AB (SE) 2003-04-17 US disclosed
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 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-20030073862-A1 Compounds PPARG, PPARA, PPARD PPARG 1/4885PPARA 2/4885MEN1 4333/4885

“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.