SCHEMBL23902259

SCHEMBL23902259

Cc1cc(COc2ccc(C3=NCCN3C)cc2)cc(COc2ccc(C3=NCCN3C)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.41
HRH3 Q9Y5N1 1/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
NPC1 O15118 2/20 0.36
F10 P00742 1/20 0.35
RAB9A P51151 1/20 0.35
GRM5 P41594 1/20 0.34

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
SCHEMBL23901944 0.85 TOP2A (0.51) PARP10HRH3MMP1MMP2MMP9
SCHEMBL23902286 0.84 MMP2 (0.41) PARP10HRH3MMP1MMP2MMP9
SCHEMBL23901806 0.84 FFAR4 (0.40) HRH3F10
SCHEMBL23902202 0.82 NPC1 (0.41) HRH3NPC1RAB9A
SCHEMBL23901853 0.81 PTAFR (0.41) HRH3F10
Hydrochloric Acid SCHEMBL23880741 0.80 PTAFR (0.40) HRH3F10
SCHEMBL23880701 0.78 PARP10 (0.42) PARP10HRH3MMP1MMP2MMP9
SCHEMBL23901790 0.75 NPC1 (0.42) NPC1RAB9A
SCHEMBL8286902 0.75 PTAFR (0.46) F10
SCHEMBL34433936 0.74 HDAC8 (0.43) PARP10MMP1MMP2MMP9

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 PARP10 1888/4885HRH3 178/4885MMP1 3804/4885

“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.