SCHEMBL23902145

SCHEMBL23902145

N=C(N)c1ccc(C#Cc2cccc(C#Cc3ccc(C4=NCCN4)cc3)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.48
ASIC3 Q9UHC3 1/20 0.45
NISCH Q9Y2I1 10/20 0.44
FDPS P14324 1/20 0.43
F10 P00742 1/20 0.42
LMNA P02545 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL23902187 0.93 NISCH (0.46) MAOBASIC3NISCHFDPSF10
SCHEMBL23902144 0.87 MAOB (0.60) MAOBNISCHLMNARECQL
SCHEMBL23902309 0.82 NISCH (0.55) MAOBNISCHLMNARECQL
SCHEMBL23901782 0.79 NISCH (0.58) MAOBNISCH
SCHEMBL15788088 0.79 MAOB (0.74) MAOBNISCHFDPS
SCHEMBL8195812 0.78 NISCH (0.71) MAOBNISCHLMNARECQL
SCHEMBL23902138 0.78 ASIC3 (0.67) ASIC3F10LMNARECQL
SCHEMBL23902159 0.78 NISCH (0.52) NISCHFDPSF10
SCHEMBL23902160 0.78 PRMT1 (0.48) NISCHFDPSF10
SCHEMBL23902299 0.75 NISCH (0.48) MAOBNISCHFDPSF10

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-20210309641-A1 AMIDINES AND AMIDINE ANALOGS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION ANTIBIOTICS GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2021-10-07 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-20210309641-A1 AMIDINES AND AMIDINE ANALOGS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION ANTIBIOTICS PAM, AMPD1, AMPD3 MAOB 2311/4885ASIC3 1204/4885NISCH 24/4885

“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.