SCHEMBL28976746

SCHEMBL28976746

COc1nnc(C)c(C(N)=O)c1C1CCC(F)(F)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.33
▸ OPRM1 P35372 1/20 0.32

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
SCHEMBL28976466 0.86 PARP1 (0.33) OPRM1
SCHEMBL28976422 0.78 KDM1A (0.36) OPRM1
SCHEMBL28976333 0.74 OPRM1 (0.32) POLBOPRM1
SCHEMBL28976932 0.74 KDM1A (0.39) OPRM1
SCHEMBL28976385 0.73 KDM1A (0.38) OPRM1
SCHEMBL28976390 0.72 KDM1A (0.38) OPRM1
SCHEMBL28976525 0.72 SCN10A (0.35) POLBOPRM1
SCHEMBL28976619 0.71 KDM1A (0.37) OPRM1
SCHEMBL28976512 0.71 IRAK4 (0.35) —
SCHEMBL28976927 0.68 PARP1 (0.33) OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115884810-A Imidazopyridazines as IL-17 modulators 詹森药业有限公司 2023-03-31 — — CN disclosed
Send feedback