SCHEMBL30423903

SCHEMBL30423903

O=C1CCCC2(CCN(c3cc(OC4CCOCC4)nc(CO)n3)CC2)N1c1ccc(F)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.41
EP300 Q09472 1/20 0.32
RAF1 P04049 4/20 0.31
BRAF P15056 4/20 0.31
PIK3CD O00329 2/20 0.31
AKT1 P31749 2/20 0.31
PIK3CA P42336 2/20 0.31
PIK3CB P42338 2/20 0.31
WEE1 P30291 1/20 0.30
TRPV4 Q9HBA0 1/20 0.30

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
SCHEMBL24253653 1.00 PDE10A (0.41) PDE10AEP300RAF1BRAFPIK3CD
SCHEMBL24253869 0.95 PDE10A (0.36) PDE10AEP300WEE1
SCHEMBL24253840 0.90 PDE10A (0.31) PDE10A
SCHEMBL24253951 0.88 PDE10A (0.37) PDE10AEP300RAF1BRAFAKT1
SCHEMBL30423914 0.88 PDE10A (0.37) PDE10AEP300RAF1BRAFAKT1
SCHEMBL24253867 0.87
SCHEMBL30494592 0.86 EP300 (0.35) PDE10AEP300RAF1BRAFPIK3CD
SCHEMBL24253647 0.86 EP300 (0.35) PDE10AEP300RAF1BRAFPIK3CD
SCHEMBL24253950 0.85 GPR119 (0.36) PDE10AEP300
SCHEMBL24253733 0.84 PDE10A (0.33) PDE10AEP300AKT1PIK3CAWEE1

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
EP-4196478-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF Novartis AG (CH) 2023-06-21 EP claimed
CN-116157404-A Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof 诺华股份有限公司 2023-05-23 CN claimed
EP-4196478-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF Novartis AG (CH) 2023-06-21 EP disclosed
CN-116157404-A Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof 诺华股份有限公司 2023-05-23 CN disclosed