SCHEMBL28474245

SCHEMBL28474245

CC1(Nc2ccc(C(N)=O)nn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.45
GSK3B P49841 1/20 0.36
PIM1 P11309 2/20 0.32
PIM2 Q9P1W9 1/20 0.32
SCN9A Q15858 2/20 0.31
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
GLS O94925 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
SIRT6 Q8N6T7 1/20 0.30
FPR2 P25090 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
SCHEMBL28479219 0.86 NNMT (0.41) NNMTGSK3B
SCHEMBL28473395 0.78 NNMT (0.42) NNMTGSK3BGLS
Hydracarbazine SCHEMBL308554 0.73 NNMT (0.55) NNMTGSK3BPIM1SIRT6
SCHEMBL4889620 0.72 HCAR3 (0.46) NNMTPIM1
SCHEMBL3174330 0.72 NNMT (0.67) NNMTGSK3BPIM1SIRT6
SCHEMBL7667785 0.71 NNMT (0.49) NNMTGSK3B
SCHEMBL31211632 0.70 NNMT (0.47) NNMTGSK3BGLS
SCHEMBL28476212 0.69 DGAT1 (0.42) NNMTGSK3BGLS
SCHEMBL28477862 0.68 GSK3B (0.44) NNMTGSK3BGLS
SCHEMBL5042245 0.68 HCAR3 (0.48) NNMTGSK3BSCN9AFPR2

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
CN-117263918-A Pyridazine derivative inhibitor, preparation method and application thereof 江苏豪森药业集团有限公司 2023-12-22 CN disclosed
CN-111757878-B Pyridazine derivative inhibitor, preparation method and application thereof 江苏豪森药业集团有限公司 2023-07-28 CN disclosed
CN-115448910-A Pyridazine derivative inhibitor, and preparation method and application thereof 江苏豪森药业集团有限公司 2022-12-09 CN disclosed
CN-111757878-A Pyridazine derivative inhibitor, and preparation method and application thereof 江苏豪森药业集团有限公司 2020-10-09 CN disclosed