SCHEMBL23902306

SCHEMBL23902306

Cc1cc(OCc2ccc(C3=NCCN3)cc2)cc(OCc2ccc(C3=NCCN3)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 13/20 0.56
KDM4E B2RXH2 1/20 0.48
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
PTGIR P43119 1/20 0.46
HTR1D P28221 1/20 0.46
ADRA1A P35348 1/20 0.46

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
SCHEMBL23566027 0.86 NISCH (0.56) NISCHMAOBPTGIRHTR1DADRA1A
SCHEMBL23902218 0.86 NISCH (0.56) NISCHMAOB
SCHEMBL14519334 0.86 NISCH (0.61) NISCHMAOBPTGIR
Hydrochloric Acid SCHEMBL23880700 0.85 NISCH (0.55) NISCHKDM4EMAOBPTGIR
SCHEMBL23902340 0.83 NISCH (0.49) NISCHKDM4EMAOB
SCHEMBL23235758 0.82 NISCH (0.59) NISCHKDM4EPTGIR
SCHEMBL23902291 0.82 NISCH (0.51) NISCHMAOB
SCHEMBL23902330 0.80 NISCH (0.50) NISCHKDM4EMAOBPTGIR
SCHEMBL23566464 0.79 NISCH (0.58) NISCH
SCHEMBL23901773 0.78 NISCH (0.53) NISCHMAOB

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 NISCH 24/4885KDM4E 4802/4885MAOA 2663/4885

“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.