SCHEMBL23902117

SCHEMBL23902117

C(=C/c1cccc(/C=C/c2ccc(C3=NCCN3)cc2)c1)\c1ccc(C2=NCCN2)cc1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 4/20 0.59
NISCH Q9Y2I1 10/20 0.57
BLM P54132 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
LMNA P02545 1/20 0.51
RECQL P46063 1/20 0.51
TOP2A P11388 1/20 0.50
TOP2B Q02880 1/20 0.50
ADRA2A P08913 1/20 0.50
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50

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
SCHEMBL23902308 0.94 NISCH (0.55) PRMT1NISCHBLMTDP1TOP2A
SCHEMBL23901781 0.91 NISCH (0.58) PRMT1NISCHBLMTDP1TOP2A
SCHEMBL9575289 0.90 PRMT1 (0.64) PRMT1NISCHBLMTDP1LMNA
SCHEMBL23902160 0.87 PRMT1 (0.48) PRMT1NISCHBLMTDP1
SCHEMBL23902185 0.79 NISCH (0.46) PRMT1NISCHBLMTDP1TOP2A
SCHEMBL5476725 0.78 NISCH (0.79) NISCHLMNARECQLTOP2ATOP2B
SCHEMBL8201031 0.78 NISCH (0.54) NISCHMAOB
SCHEMBL8201034 0.78 NISCH (0.54) NISCHMAOB
SCHEMBL3532726 0.76 NISCH (0.65) NISCHLMNARECQLTOP2ATOP2B
SCHEMBL27619343 0.76 NISCH (0.59) NISCHBLMTDP1LMNARECQL

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 PRMT1 1328/4885NISCH 24/4885BLM 925/4885

“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.