SCHEMBL1414929

SCHEMBL1414929

Cc1c(O)ccc2cc(C(=O)c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)ccc12

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 11/20 0.36
LCK P06239 4/20 0.34
IGFBP3 P17936 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
EGFR P00533 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 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 0.85 SIRT2 (0.37) SIRT2LCKALDH1A1NPC1RAB9A
SCHEMBL1414925 0.83 SIRT2 (0.34) SIRT2
SCHEMBL4030987 0.82 MEN1 (0.51) SIRT2IGFBP3MEN1NPC1RAB9A
SCHEMBL1414946 0.82 SIRT2 (0.34) SIRT2
SCHEMBL4024355 0.80 SIRT2 (0.41) SIRT2NPC1RAB9AMAPT
SCHEMBL313125 0.80 ACSS2 (0.43) SIRT2
SCHEMBL5678341 0.80 KDM4E (0.46) SIRT2ALDH1A1MEN1KMT2AHPGD
SCHEMBL4031880 0.80 CTNNB1 (0.34) SIRT2ALDH1A1MEN1RAB9AKMT2A
SCHEMBL5682251 0.78 LMNA (0.42) SIRT2ALDH1A1RAB9AKMT2AMAPT
SCHEMBL5748437 0.78 SIRT2 (0.36) SIRT2HPGD

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 2362/4885LCK 3457/4885IGFBP3 832/4885

“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.