SCHEMBL5654832

SCHEMBL5654832

CC(=O)On1cncc1CSc1ccc(N)cc1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PKM P14618 1/20 0.31

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
SCHEMBL5657489 0.78 ADORA2B (0.36) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL5657484 0.78 MEN1 (0.31) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL5654563 0.74 NPC1 (0.33) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL5657511 0.73 CYP11B1 (0.33)
SCHEMBL21558286 0.72 ALDH1A1 (0.38) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL6526804 0.70 MEN1 (0.36) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL21558438 0.69 NPC1 (0.36) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL21558283 0.68 TLR8 (0.37) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL21558432 0.66 NPC1 (0.35) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL7111764 0.64 CYP3A4 (0.41) ALDH1A1KMT2AMEN1NPC1RAB9A

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-7262185-B2 Benzazepine derivative, process for producing the same, and use TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2007-08-28 US disclosed
US-20040235822-A1 Benzazepine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-11-25 US disclosed
EP-1422228-A1 BENZAZEPINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Chemical Industries, Ltd. (JP) 2004-05-26 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-20040235822-A1 Benzazepine derivative, process for producing the same, and use CYP1B1, CYP1A1, CYP2E1 ALDH1A1 519/4885KMT2A 391/4885MEN1 729/4885

“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.