SCHEMBL5567623

SCHEMBL5567623

Nc1ccc(CCCCCn2c(Cc3nnn[nH]3)nc3c(=O)[nH]c(=O)[nH]c32)cc1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.31
▸ USP2 O75604 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ RGS12 O14924 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ HTT P42858 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
SCHEMBL4416340 0.80 PLA2G7 (0.39) MEN1USP2MAPTKMT2AKDM4E
SCHEMBL4416381 0.80 GAA (0.39) MEN1USP2MAPTKMT2AKDM4E
SCHEMBL4414439 0.68 POLB (0.37) MEN1USP2KMT2APOLB
SCHEMBL4416313 0.68 CYP19A1 (0.37) MAPTKMT2A
SCHEMBL9057541 0.66 MAOB (0.44) MEN1MAPTKMT2AKDM4EHTT
SCHEMBL4573094 0.64 CYP3A4 (0.48) USP2MAPTKDM4EPOLBHTT
SCHEMBL4551899 0.64 ADORA2B (0.58) —
SCHEMBL13092524 0.63 GFER (0.52) MEN1MAPTKMT2AHTT
SCHEMBL1333226 0.63 ADORA2B (0.42) KMT2A
SCHEMBL9479523 0.59 MAPT (0.39) MEN1MAPTKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070161629-A1 A1 Adenosine Receptor Antagonists ENDACEA, INC. (US) 2007-07-12 — — 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-20070161629-A1 A1 Adenosine Receptor Antagonists ADORA1, ADORA2A, ADORA3 MEN1 1714/4885USP2 4422/4885MAPT 4733/4885

“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.

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