SCHEMBL4301286

SCHEMBL4301286

CCOCN(C(=O)OC(C)(C)C)n1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(C)c(C)c21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.36
ALDH1A1 P00352 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
AKT1 P31749 3/20 0.32
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
CCNE2 O96020 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30

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
SCHEMBL4296135 0.92 MCL1 (0.35) MCL1ALDH1A1HDAC3HDAC1HDAC2
SCHEMBL4304126 0.84 MCL1 (0.34) MCL1ALDH1A1HDAC3HDAC1HDAC2
SCHEMBL4298198 0.81
SCHEMBL4301280 0.73 AKT1 (0.41) HDAC3HDAC1HDAC2NCOR2AKT1
SCHEMBL4302601 0.69
SCHEMBL4305886 0.68 KMT2A (0.34) ALDH1A1POLB
SCHEMBL4301350 0.66 RAB9A (0.43) ALDH1A1AKT1POLBHSD17B10CTSL
SCHEMBL4296131 0.65 AKT1 (0.40) HDAC3HDAC1HDAC2NCOR2AKT1
SCHEMBL5818571 0.64 LMNA (0.36) ALDH1A1HDAC3HDAC1HDAC2NCOR2
SCHEMBL4302676 0.62 MEN1 (0.48) ALDH1A1HDAC3HDAC1HDAC2NCOR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. 2009-10-29 US disclosed
WO-2006026760-A2 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-09 WO 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-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS IL2, IL4I1, IFNG MCL1 264/4885ALDH1A1 821/4885HDAC3 857/4885

“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.