SCHEMBL1486550

SCHEMBL1486550

CCc1nc2cnc3cc(OCc4ccccc4)ccc3c2n1CCCCN(C(=O)O)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NMT1 P30419 7/20 0.38
NMT2 O60551 3/20 0.38
ALOX5AP P20292 4/20 0.37
EGLN2 Q96KS0 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
MEN1 O00255 1/20 0.36
HSP90AA1 P07900 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
TLR7 Q9NYK1 2/20 0.36
ACSS2 Q9NR19 1/20 0.35
SRD5A2 P31213 1/20 0.35

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
SCHEMBL1486668 0.93 TLR7 (0.40) NMT1NMT2ALOX5APEGLN2EGLN1
SCHEMBL1486615 0.91 TLR7 (0.45) TLR7
SCHEMBL1486554 0.88 MAPT (0.38) ALOX5APEGLN2EGLN1TLR7
SCHEMBL1486560 0.87 NMT1 (0.41) NMT1NMT2MEN1HSP90AA1KMT2A
SCHEMBL1486653 0.87 TLR7 (0.48) TLR7
SCHEMBL2506895 0.85 TLR7 (0.41) TLR7
SCHEMBL3867677 0.84 BRD4 (0.43) NMT1NMT2MEN1HSP90AA1KMT2A
SCHEMBL27640490 0.83 NMT1 (0.40) NMT1NMT2
SCHEMBL27640403 0.82 CYP3A4 (0.39) NMT1NMT2MEN1KMT2AACSS2
SCHEMBL4240323 0.79 TP53 (0.45) MEN1KMT2A

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-8263594-B2 Aryloxy and arylalkyleneoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-09-11 US disclosed
US-20110144099-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY 2011-06-16 US disclosed
US-7897597-B2 Aryloxy and arylalkyleneoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-03-01 US 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-20110144099-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES IL2, IFNG, IRF3 NMT1 3677/4885NMT2 3204/4885ALOX5AP 849/4885

“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.