SCHEMBL1414809

SCHEMBL1414809

COC(=O)c1ccc2cc(C(=O)c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)ccc2c1CBr

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 13/20 0.37
ALOX5AP P20292 2/20 0.34
ACSS2 Q9NR19 1/20 0.33
LCK P06239 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 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
SCHEMBL1414832 0.87 SIRT2 (0.37) SIRT2ALOX5APLCKNPC1RAB9A
SCHEMBL4024355 0.83 SIRT2 (0.41) SIRT2ACSS2NPC1RAB9A
SCHEMBL5678341 0.77 KDM4E (0.46) SIRT2KMT2A
SCHEMBL1414929 0.77 SIRT2 (0.36) SIRT2LCKNPC1RAB9AKMT2A
SCHEMBL5682251 0.75 LMNA (0.42) SIRT2ACSS2RAB9AKMT2A
SCHEMBL313125 0.75 ACSS2 (0.43) SIRT2ACSS2
SCHEMBL1414925 0.74 SIRT2 (0.34) SIRT2
SCHEMBL4030987 0.74 MEN1 (0.51) SIRT2NPC1RAB9AKMT2A
SCHEMBL4024513 0.73 CA12 (0.38) SIRT2
SCHEMBL1829222 0.73 SIRT2 (0.47) SIRT2KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1344777-B1 IMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE TAKEDA PHARMACEUTICAL (JP) 2011-03-16 EP disclosed
US-6960586-B2 Imidazole derivatives, process for their preparation and their use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-01 US disclosed
US-20040024039-A1 Imidazole derivatives, process for their preparation and their use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-02-05 US disclosed
EP-1344777-A1 IMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE Takeda Chemical Industries, Ltd. (JP) 2003-09-17 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-20040024039-A1 Imidazole derivatives, process for their preparation and their use CYP17A1, HSD17B7, CYP51A1 SIRT2 2362/4885ALOX5AP 1498/4885ACSS2 1354/4885

“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.