SCHEMBL24770872

SCHEMBL24770872

CCOC(=O)c1c(C)cc(C2CNC2)nc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
CYP3A4 P08684 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 4/20 0.42
GAA P10253 3/20 0.42
HPGD P15428 2/20 0.42
RAB9A P51151 2/20 0.42
LMNA P02545 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PDE4D Q08499 1/20 0.41
POLB P06746 2/20 0.40
PLAT P00750 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
ADORA3 P0DMS8 2/20 0.39
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39

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
SCHEMBL3762875 0.87 KDM4E (0.46) ALDH1A1SMN1; SMN2CYP3A4TDP1KDM4E
SCHEMBL29175617 0.76 GPR119 (0.42) ALDH1A1SMN1; SMN2KDM4EGAAHPGD
SCHEMBL30030074 0.76 GPR119 (0.42) ALDH1A1SMN1; SMN2KDM4EGAAHPGD
SCHEMBL7362801 0.75 POLB (0.60) ALDH1A1SMN1; SMN2CYP3A4TDP1KDM4E
SCHEMBL24770883 0.74 PDE4B (0.42) ALDH1A1SMN1; SMN2TDP1KDM4EGAA
SCHEMBL1296287 0.73 CYP3A4 (0.56) ALDH1A1SMN1; SMN2CYP3A4TDP1KDM4E
SCHEMBL9523494 0.73 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2CYP3A4TDP1KDM4E
SCHEMBL3277897 0.72 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2CYP3A4TDP1KDM4E
SCHEMBL22453926 0.72 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2CYP3A4TDP1KDM4E
SCHEMBL13934247 0.72 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2CYP3A4TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117500785-A Azetidinyl-containing carboxylic acid compounds for the treatment of neurodegenerative diseases 细胞基因公司 2024-02-02 CN disclosed
US-20230028747-A1 Carboxylic Acid Containing Azetidinyl Compounds for the Treatment of Neurodegenerative Diseases CELGENE CORPORATION (US) 2023-01-26 US disclosed
WO-2022266162-A1 AZETIDINYL COMPOUNDS COMPRISING A CARBOXYLIC ACID GROUP FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES CELGENE CORPORATION (US) 2022-12-22 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-20230028747-A1 Carboxylic Acid Containing Azetidinyl Compounds for the Treatment of Neurodegenerative Diseases S1PR5, LPAR5, S1PR2 ALDH1A1 1161/4885SMN1; SMN2 15/4885CYP3A4 4646/4885

“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.