SCHEMBL30450121

SCHEMBL30450121

O=C(O)C1C2C=CC(C2)C1C(=O)Nc1nc2ccc(-c3ccncc3)cc2s1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.66
ITK Q08881 2/20 0.63
ABL1 P00519 14/20 0.55
PDGFRA P16234 2/20 0.51
KIT P10721 1/20 0.51
PIK3CG P48736 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
SCHEMBL25306737 1.00 ALDH1A1 (0.66) ALDH1A1ITKABL1PDGFRAKIT
SCHEMBL30450168 0.90 ALDH1A1 (0.66) ALDH1A1ITKABL1KITPIK3CG
SCHEMBL30450724 0.90 ALDH1A1 (0.68) ALDH1A1ITKABL1PDGFRAKIT
SCHEMBL25259451 0.90 ALDH1A1 (0.66) ALDH1A1ITKABL1KITPIK3CG
SCHEMBL25260232 0.90 ALDH1A1 (0.68) ALDH1A1ITKABL1PDGFRAKIT
SCHEMBL25833484 0.90 ALDH1A1 (0.66) ALDH1A1ITKABL1KITPIK3CG
SCHEMBL25833432 0.90 ALDH1A1 (0.68) ALDH1A1ITKABL1PDGFRAKIT
SCHEMBL25262799 0.89 ALDH1A1 (0.62) ALDH1A1ITKABL1PIK3CG
SCHEMBL30450160 0.89 ALDH1A1 (0.62) ALDH1A1ITKABL1PIK3CG
SCHEMBL25833569 0.89 ALDH1A1 (0.62) ALDH1A1ITKABL1PIK3CG

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4460500-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE - INSERM (FR) 2024-11-13 EP claimed
CN-118660885-A Norbornene analogs and their use as potentiators of antitubercular drugs 国家医疗保健研究所 2024-09-17 CN claimed
WO-2023131649-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-07-13 WO claimed
EP-4460500-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE - INSERM (FR) 2024-11-13 EP disclosed
CN-118660885-A Norbornene analogs and their use as potentiators of antitubercular drugs 国家医疗保健研究所 2024-09-17 CN disclosed
WO-2023131649-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-07-13 WO disclosed