SCHEMBL5207548

SCHEMBL5207548

Cc1ccc(C)c(CNC(=O)CCc2oc(-n3cnc4ccccc43)nc2-c2ccc(Cl)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.41
LMNA P02545 1/20 0.41
NPC1 O15118 1/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ASAH1 Q13510 1/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 1/20 0.37
HPGD P15428 1/20 0.36
MAPT P10636 1/20 0.36
PIK3CD O00329 1/20 0.36
P2RX7 Q99572 1/20 0.35
ENPP2 Q13822 1/20 0.35
XBP1 P17861 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL5210310 0.95 P2RX7 (0.39) TP53LMNAASAH1POLBSMN1; SMN2
SCHEMBL5211694 0.94 TP53 (0.42) TP53LMNANPC1MEN1KMT2A
SCHEMBL5209795 0.91 ASAH1 (0.38) TP53LMNAKMT2AASAH1POLB
SCHEMBL5208698 0.89 TP53 (0.46) TP53LMNANPC1MEN1KMT2A
SCHEMBL5210908 0.88 PKM (0.42) TP53LMNAMEN1KMT2APOLB
SCHEMBL5209979 0.87 CNR1 (0.39) TP53LMNAKMT2APOLBSMN1; SMN2
SCHEMBL5211863 0.87 CNR1 (0.42) TP53LMNASMN1; SMN2HPGDMAPT
SCHEMBL5206933 0.86 ENPP2 (0.47) TP53LMNAMEN1KMT2APOLB
SCHEMBL5210428 0.86 ENPP2 (0.45) TP53LMNAKMT2APOLBSMN1; SMN2
SCHEMBL5212575 0.85 ENPP2 (0.49) TP53LMNAMEN1KMT2AASAH1

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 TP53 4375/4885LMNA 4253/4885NPC1 3792/4885

“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.