SCHEMBL30725915

SCHEMBL30725915

CC(=O)c1ccc2c(c1)N(C(C)=O)c1ccccc1[S+]2[O-]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOX1 Q9Y5S8 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SNCA P37840 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ S100A4 P26447 1/20 0.36
▸ PRNP P04156 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CHRM2 P08172 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
SCHEMBL24439324 1.00 NOX1 (0.43) NOX1MAPTL3MBTL1LMNAMAPK1
SCHEMBL24439313 0.83 HSD17B3 (0.41) NOX1MAPTSMN1; SMN2GAANPSR1
SCHEMBL24439587 0.81 SNCA (0.43) NOX1MAPTSMN1; SMN2GAANPSR1
SCHEMBL24439580 0.80 P2RX4 (0.43) NOX1MAPTL3MBTL1LMNASMN1; SMN2
SCHEMBL30725909 0.80 P2RX4 (0.43) NOX1MAPTL3MBTL1LMNASMN1; SMN2
SCHEMBL11372576 0.77 NR1I3 (0.45) L3MBTL1TDP1
SCHEMBL14292101 0.77 DRD2 (0.46) NOX1MAPTL3MBTL1LMNAMAPK1
SCHEMBL11375813 0.76 TBXAS1 (0.39) SMN1; SMN2ALDH1A1
SCHEMBL13986605 0.72 P2RX4 (0.51) NOX1MAPTL3MBTL1LMNAMAPK1
SCHEMBL4806681 0.71 KDM4E (0.68) MAPTL3MBTL1KDM4EALDH1A1MEN1

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-20240025868-A1 PHENOTHIAZINE COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND OTHER AGE-RELATED AND NEUROLOGICAL DISEASES ICAHN SCHOOL MED MOUNT SINAI (US) 2024-01-25 — — 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-20240025868-A1 PHENOTHIAZINE COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND OTHER AGE-RELATED AND NEUROLOGICAL DISEASES ACE2, BACE2, PSEN2 NOX1 2388/4885MAPT 11/4885L3MBTL1 2587/4885

“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.

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