SCHEMBL5208451

SCHEMBL5208451

CC(C)c1nc(Cl)sc1C=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.36
MAPT P10636 6/20 0.36
KMT2A Q03164 6/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 3/20 0.34
GLA P06280 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PSMD14 O00487 1/20 0.33
POLB P06746 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
SCHEMBL859722 0.73
SCHEMBL7233939 0.73 NPC1 (0.33) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL2517642 0.72
SCHEMBL17385370 0.72 MEN1 (0.41) MEN1MAPTKMT2AALDH1A1KDM4E
Ethylene SCHEMBL3310698 0.70 LMNA (0.36) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL21737735 0.68
SCHEMBL5212039 0.68 MEN1 (0.35) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL9643967 0.67 ALDH1A1 (0.58) MAPTKMT2AALDH1A1KDM4ELMNA
SCHEMBL25407831 0.65 ALOX15 (0.47) MEN1MAPTKMT2AALDH1A1KDM4E
SCHEMBL11160531 0.64 FBP1 (0.33)

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 MEN1 1626/4885MAPT 3958/4885KMT2A 680/4885

“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.