SCHEMBL24349403

SCHEMBL24349403

NCc1cccc(CO)c1O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.46
GABRB2 P47870 2/20 0.46
PNMT P11086 3/20 0.43
DPP4 P27487 2/20 0.41
APOBEC3G Q9HC16 1/20 0.38
LMNA P02545 1/20 0.37
HMGB1 P09429 1/20 0.37
ABAT P80404 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
ENPP2 Q13822 1/20 0.37
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.35

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
SCHEMBL20182944 0.90 GABRA1 (0.55) GABRA1GABRB2PNMTDPP4LMNA
SCHEMBL196227 0.87 GABRA1 (0.57) GABRA1GABRB2APOBEC3GLMNAPDCD1
SCHEMBL124524 0.80 GABRA1 (0.50) GABRA1GABRB2APOBEC3GLMNAHMGB1
SCHEMBL23486766 0.80 GABRA1 (0.50) GABRA1GABRB2APOBEC3GLMNAHMGB1
SCHEMBL366656 0.78 ADAMTS4 (0.52) GABRA1GABRB2PNMTLMNATAAR1
SCHEMBL2553273 0.77 DPP4 (0.52) PNMTDPP4APOBEC3GTAAR1PDCD1
SCHEMBL29437737 0.77 DPP4 (0.52) PNMTDPP4APOBEC3GTAAR1PDCD1
SCHEMBL11744835 0.76 PNMT (0.43) PNMTDPP4APOBEC3GTAAR1PDCD1
Hydrochloric Acid SCHEMBL1998632 0.76 ADAMTS4 (0.50) GABRA1GABRB2PNMTLMNATAAR1
SCHEMBL11648774 0.76 GABRA1 (0.81) GABRA1GABRB2APOBEC3GLMNAPDCD1

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-20220112152-A1 TRIPHENYLPHOSPHONIUM-TETHERED SALICYLAMINE DERIVATIVES MTI BIOTECH, INC. 2022-04-14 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-20220112152-A1 TRIPHENYLPHOSPHONIUM-TETHERED SALICYLAMINE DERIVATIVES SHMT2, HSPA9, GOT2 GABRA1 4084/4885GABRB2 3555/4885PNMT 146/4885

“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.