SCHEMBL25837853

SCHEMBL25837853

CCc1cn(-c2nccc(Cl)n2)cn1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 2/20 0.38
RPS6KA4 O75676 2/20 0.38
NOS1 P29475 3/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PANK3 Q9H999 1/20 0.33
SORD Q00796 1/20 0.31
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31
GRM5 P41594 1/20 0.30
GRM1 Q13255 1/20 0.30

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
SCHEMBL22900743 0.84 RPS6KA5 (0.38) RPS6KA5RPS6KA4NOS1MEN1ALDH1A1
SCHEMBL22901013 0.78 RPS6KA5 (0.32) RPS6KA5RPS6KA4NOS1
SCHEMBL10160988 0.78 GRM5 (0.33) GRM5GRM1
SCHEMBL25837852 0.73
SCHEMBL25837854 0.73 CA1 (0.39) L3MBTL1
SCHEMBL22900755 0.72 RPS6KA5 (0.38) RPS6KA5RPS6KA4MEN1ALDH1A1MAPT
SCHEMBL22185880 0.70 MAP4K4 (0.42) MAPT
SCHEMBL22185837 0.70 POLB (0.50) MAPTL3MBTL1
SCHEMBL22185259 0.69 CPB1 (0.33) ALDH1A1KMT2AGRM5GRM1
SCHEMBL7593026 0.69 ALDH1A1 (0.60) RPS6KA5RPS6KA4MEN1ALDH1A1MAPT

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-11691967-B2 Antibiotics effective for gram-negative pathogens THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2023-07-04 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-11691967-B2 Antibiotics effective for gram-negative pathogens PGLS, MGAM, GMDS RPS6KA5 463/4885RPS6KA4 239/4885NOS1 2993/4885

“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.