SCHEMBL30041003

SCHEMBL30041003

Cc1cc(NC[C@@H](C)O)nnc1-c1ccc(C(F)(F)F)cc1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 4/20 0.49
IL1B P01584 8/20 0.46
TNF P01375 2/20 0.46
TRPV3 Q8NET8 2/20 0.39
BRAF P15056 2/20 0.36
KDR P35968 2/20 0.36
MAPK14 Q16539 2/20 0.36
TNNI3K Q59H18 2/20 0.36
FAAH O00519 2/20 0.34
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
CHRM1 P11229 1/20 0.34

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
SCHEMBL30042494 0.89 NLRP3 (0.61) NLRP3IL1BTNFCHRM1
SCHEMBL30042640 0.81 NLRP3 (0.62) NLRP3IL1BTNFTRPV3BRAF
SCHEMBL30042431 0.77 NLRP3 (0.54) NLRP3IL1BTNFTRPV3
SCHEMBL30214344 0.74 NLRP3 (0.43) NLRP3IL1BTRPV3BRAFKDR
SCHEMBL30042285 0.73 NLRP3 (0.59) NLRP3IL1BTNFTRPV3
SCHEMBL30040903 0.71 NLRP3 (0.77) NLRP3IL1BTNFBRAFKDR
SCHEMBL29326352 0.71 NLRP3 (0.62) NLRP3IL1BTNFBRAF
SCHEMBL30129714 0.71 IL1B (0.45) NLRP3IL1BTNFTRPV3
SCHEMBL26940804 0.70 NLRP3 (0.52) NLRP3IL1BTNFCHRM1
SCHEMBL26938431 0.70 NLRP3 (0.39) NLRP3IL1BTNFCHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4129986-B1 SUBSTITUTED PYRIDAZINE COMPOUND TENVIE THERAPEUTICS INC (US) 2026-03-11 EP claimed
CN-115279739-A Substituted pyridazine compounds 安斯泰来制药株式会社 2022-11-01 CN claimed
CN-115279739-A Substituted pyridazine compounds 安斯泰来制药株式会社 2022-11-01 CN disclosed