SCHEMBL23902144

SCHEMBL23902144

C(#Cc1cccc(C#Cc2ccc(C3=NCCN3)cc2)c1)c1ccc(C2=NCCN2)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.60
NISCH Q9Y2I1 13/20 0.57
LMNA P02545 1/20 0.51
RECQL P46063 1/20 0.51
TOP2A P11388 1/20 0.50
TOP2B Q02880 1/20 0.50
ALDH1A1 P00352 1/20 0.49
CYP1A2 P05177 1/20 0.49
HPGD P15428 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HTR1D P28221 1/20 0.49
ADRA1A P35348 1/20 0.49

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
SCHEMBL23902309 0.94 NISCH (0.55) MAOBNISCHLMNARECQLTOP2A
SCHEMBL23901782 0.91 NISCH (0.58) MAOBNISCHTOP2ATOP2B
SCHEMBL15788088 0.90 MAOB (0.74) MAOBNISCHALDH1A1CYP1A2HPGD
SCHEMBL8195812 0.90 NISCH (0.71) MAOBNISCHLMNARECQLTOP2A
SCHEMBL23902145 0.87 MAOB (0.48) MAOBNISCHLMNARECQL
SCHEMBL23902187 0.79 NISCH (0.46) MAOBNISCHTOP2ATOP2B
SCHEMBL5476725 0.78 NISCH (0.79) NISCHLMNARECQLTOP2ATOP2B
SCHEMBL19462115 0.78 MAOB (0.65) MAOBNISCHLMNARECQLTOP2A
SCHEMBL19877199 0.76 NISCH (0.59) NISCHLMNARECQLTOP2ATOP2B
SCHEMBL21103117 0.76 NISCH (0.58) MAOBNISCHLMNARECQLALDH1A1

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 2311/4885NISCH 24/4885LMNA 2726/4885

“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.