SCHEMBL28976525

SCHEMBL28976525

COc1nc(C(N)=O)c(C)nc1C1CCC(F)(F)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 1/20 0.35
▸ DGAT1 O75907 10/20 0.32
▸ SOAT1 P35610 6/20 0.32
▸ FAAH O00519 1/20 0.32
▸ CHRM2 P08172 1/20 0.32
▸ DGAT2 Q96PD7 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ FFAR2 O15552 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ ROCK2 O75116 1/20 0.31
▸ ROCK1 Q13464 1/20 0.31
▸ CHRNA7 P36544 1/20 0.31
▸ OPRM1 P35372 1/20 0.30
▸ KCNQ3 O43525 1/20 0.30
▸ KCNQ2 O43526 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
SCHEMBL17497128 0.88 DGAT1 (0.39) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL28976697 0.85 SCN10A (0.37) SCN10ADGAT1SOAT1FAAHCHRM2
SCHEMBL28976633 0.82 DGAT1 (0.38) SCN10ADGAT1SOAT1FAAHCHRM2
SCHEMBL28976577 0.78 SCN10A (0.33) SCN10AFFAR2OPRM1
SCHEMBL28976333 0.77 OPRM1 (0.32) PDE10AFFAR2POLBROCK2ROCK1
SCHEMBL28976419 0.75 KDM4E (0.40) SCN10AROCK2ROCK1
SCHEMBL28976746 0.72 POLB (0.33) POLBOPRM1
SCHEMBL28976931 0.71 SCN10A (0.40) SCN10AFFAR2ROCK2
SCHEMBL17497132 0.71 POLB (0.36) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL7135206 0.70 POLB (0.42) DGAT1SOAT1FAAHCHRM2DGAT2

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