SCHEMBL5212376

SCHEMBL5212376

COc1ccc(OC)c(CNC(=O)CCc2oc(-n3cnc4ccccc43)nc2-c2ccc(Cl)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.45
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
TP53 P04637 4/20 0.43
TSHR P16473 2/20 0.42
MEN1 O00255 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 6/20 0.41
HSD17B10 Q99714 1/20 0.41
RXFP1 Q9HBX9 2/20 0.40
GAA P10253 2/20 0.40
THRB P10828 2/20 0.40
POLB P06746 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
SCHEMBL5213032 0.92 TP53 (0.49) LMNATP53MEN1KMT2AMAPT
SCHEMBL5211647 0.90 TP53 (0.40) LMNAALDH1A1TP53MEN1KMT2A
SCHEMBL5211199 0.89 MAPT (0.53) LMNAALDH1A1TP53MEN1KMT2A
SCHEMBL5209074 0.88 TP53 (0.45) LMNAALDH1A1TP53MEN1RAB9A
SCHEMBL5214089 0.87 KMT2A (0.49) LMNAALDH1A1TP53MEN1KMT2A
SCHEMBL5210908 0.85 PKM (0.42) LMNAL3MBTL1TP53MEN1KMT2A
SCHEMBL5209795 0.85 ASAH1 (0.38) LMNAALDH1A1L3MBTL1TP53TSHR
SCHEMBL5210310 0.85 P2RX7 (0.39) LMNAALDH1A1L3MBTL1TP53MAPT
SCHEMBL5209979 0.85 CNR1 (0.39) LMNAALDH1A1L3MBTL1TP53KMT2A
SCHEMBL5207508 0.84 ALDH1A1 (0.46) LMNAALDH1A1L3MBTL1TP53MAPT

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-7183276-B2 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-20050090534-A1 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-28 US disclosed
EP-1486490-A1 AZOLE COMPOUNDS Takeda Chemical Industries, Ltd. (JP) 2004-12-15 EP 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-20050090534-A1 Azole compounds AHR, NR0B2, NR2C2 LMNA 4253/4885ALDH1A1 1651/4885L3MBTL1 3447/4885

“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.