SCHEMBL30740872

SCHEMBL30740872

CN(C)CCN1CCN(C(=O)c2coc(-c3ccc(C(F)(F)F)cc3)n2)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 12/20 0.46
SRPK1 Q96SB4 1/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
LDHA P00338 1/20 0.40
SLC6A5 Q9Y345 1/20 0.39
SLC6A7 Q99884 1/20 0.39
SCN9A Q15858 2/20 0.39
SCN10A Q9Y5Y9 1/20 0.39
CACNA1G O43497 1/20 0.39
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL27189048 0.77 SRPK1 (0.43) STAT3SRPK1
SCHEMBL27189115 0.75 BRAF (0.43) STAT3SRPK1CYP2C9CYP2C19SLC6A5
SCHEMBL27189044 0.75 BRAF (0.41) STAT3SRPK1CYP2C9CYP2C19SIGMAR1
SCHEMBL30106378 0.75 SRPK1 (0.43) STAT3SRPK1CYP2C9CYP2C19SLC6A5
SCHEMBL29158669 0.75 CHRNB2 (0.54)
SCHEMBL30740877 0.75 HDAC1 (0.53) SCN10ASIGMAR1
SCHEMBL30740974 0.73 SIGMAR1 (0.43) STAT3SRPK1LDHASLC6A5SLC6A7
SCHEMBL30106319 0.72 BRAF (0.40) STAT3SRPK1CYP2C9CYP2C19SIGMAR1
SCHEMBL27189056 0.72 BRAF (0.41) STAT3SRPK1CYP2C9CYP2C19SIGMAR1
SCHEMBL27189058 0.72 SRPK1 (0.43) STAT3SRPK1SIGMAR1

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-117396465-A Novel oxazole derivative for preventing or treating allergic diseases and pharmaceutical composition containing the same 阿斯克里斯有限公司 2024-01-12 CN claimed
EP-4349818-A1 NOVEL OXAZOLE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME FOR PREVENTION OR TREATMENT OF ALLERGIC DISEASE Azcuris Co., Ltd. (KR) 2024-04-10 EP disclosed
CN-117396465-A Novel oxazole derivative for preventing or treating allergic diseases and pharmaceutical composition containing the same 阿斯克里斯有限公司 2024-01-12 CN disclosed