SCHEMBL24439550

SCHEMBL24439550

COc1ccc2c(c1)N(C(C)=O)c1ccccc1S2

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.69
BCHE P06276 9/20 0.62
ACHE P22303 4/20 0.62
HPGD P15428 1/20 0.61
MAPT P10636 1/20 0.58
SNCA P37840 2/20 0.56
HDAC3 O15379 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
HDAC5 Q9UQL6 1/20 0.52

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
SCHEMBL11780141 0.87 BCHE (0.56) NOX1BCHEACHEHPGDMAPT
SCHEMBL341905 0.83 NOX1 (1.00) NOX1BCHEACHEMAPTSNCA
SCHEMBL30198410 0.83 NOX1 (1.00) NOX1BCHEACHEMAPTSNCA
SCHEMBL25141524 0.82 HSPA9 (0.48) NOX1BCHEACHEHPGDMAPT
SCHEMBL11770806 0.80 BCHE (0.44) NOX1BCHEACHEHPGDMAPT
SCHEMBL30725912 0.79 NOX1 (0.73) NOX1BCHEACHEMAPTSNCA
SCHEMBL4622014 0.79 NOX1 (0.73) NOX1BCHEACHEMAPTSNCA
SCHEMBL17297109 0.79 NOX1 (0.73) NOX1BCHEACHEMAPTSNCA
SCHEMBL8870414 0.79 NOX1 (0.73) NOX1BCHEACHEMAPTSNCA
SCHEMBL31297952 0.77 MAOA (0.63) NOX1BCHEACHEHPGDMAPT

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 4 patents. 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
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
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
WO-2022104070-A2 PHENOTHIAZINE COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND OTHER AGE-RELATED AND NEUROLOGICAL DISEASES ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2022-05-19 WO 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 2388/4885BCHE 9/4885ACHE 7/4885

“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.