SCHEMBL28976940

SCHEMBL28976940

Cc1nc(C2CCC(F)(F)CC2)c(C(N)=O)n1C(C)C

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.32
▸ PARP2 Q9UGN5 1/20 0.32
▸ SCN10A Q9Y5Y9 1/20 0.32
▸ FFAR2 O15552 1/20 0.31
▸ CAMK1D Q8IU85 2/20 0.31
▸ TBK1 Q9UHD2 1/20 0.31
▸ AKT1 P31749 1/20 0.30
▸ AKT2 P31751 1/20 0.30
▸ AKT3 Q9Y243 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
SCHEMBL28974193 0.74 RET (0.33) PARP1PARP2
SCHEMBL30281265 0.71 JAK2 (0.35) PARP1PARP2
SCHEMBL28974169 0.70 KDM1A (0.36) PARP1PARP2
SCHEMBL28976439 0.70 PARP1 (0.31) PARP1PARP2
SCHEMBL28976697 0.70 SCN10A (0.37) PARP1PARP2SCN10AFFAR2
SCHEMBL28976633 0.70 DGAT1 (0.38) PARP1PARP2SCN10AFFAR2
SCHEMBL29252887 0.70 KDM1A (0.34) PARP1PARP2
SCHEMBL28976575 0.69 SCN10A (0.37) PARP1PARP2SCN10AFFAR2
SCHEMBL28976931 0.67 SCN10A (0.40) PARP1PARP2SCN10AFFAR2CAMK1D
SCHEMBL28976927 0.66 PARP1 (0.33) PARP1PARP2SCN10AFFAR2TBK1

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 2 patents. 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
EP-4143195-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 Janssen Pharmaceutica NV (BE) 2023-03-08 — — EP disclosed
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