SCHEMBL29249012

SCHEMBL29249012

COC1CCC(CS(=O)(=O)O)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
INPP5A Q14642 1/20 0.47
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
DAO P14920 1/20 0.34
GRM1 Q13255 1/20 0.33
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
KAT8 Q9H7Z6 1/20 0.31
CYP19A1 P11511 1/20 0.31

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
SCHEMBL9099973 0.82 INPP5A (0.62) INPP5AJAK2JAK1TYK2
SCHEMBL7931443 0.82
SCHEMBL965787 0.79
Hydrochloric Acid SCHEMBL27888894 0.79
SCHEMBL28645664 0.79 MAOA (0.37) MAOAMAOBDAO
SCHEMBL28359345 0.79 MAOA (0.37) MAOAMAOBDAO
SCHEMBL12289430 0.77 CYP19A1 (0.36) MAOAMAOBDAOGRM1CYP19A1
SCHEMBL8565784 0.77 CYP19A1 (0.36) MAOAMAOBDAOGRM1CYP19A1
SCHEMBL436338 0.77 CYP19A1 (0.36) MAOAMAOBDAOGRM1CYP19A1
SCHEMBL22659225 0.76 TP53 (0.49) INPP5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111699176-B Quinazolinones as PARP14 inhibitors 里邦医疗公司 2025-02-14 CN disclosed
CN-119118999-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-12-13 CN disclosed
CN-118955477-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-15 CN disclosed
CN-118903141-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-08 CN disclosed
CN-118903142-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-11-08 CN disclosed
CN-113227074-B Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-08-16 CN disclosed
CN-118388457-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-26 CN disclosed
CN-118290403-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-05 CN disclosed