SCHEMBL26436140

SCHEMBL26436140

Cc1cc(C(F)(F)F)cc(O)c1-c1nnc(NC2CCCCC2O)c2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 2/20 0.62
KCNH2 Q12809 1/20 0.62
IL1B P01584 19/20 0.58
TNF P01375 4/20 0.58

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
SCHEMBL26435635 0.88 NLRP3 (0.57) NLRP3KCNH2IL1BTNF
SCHEMBL26434878 0.88 NLRP3 (0.48) NLRP3KCNH2IL1BTNF
SCHEMBL26435052 0.87 NLRP3 (0.47) NLRP3KCNH2IL1BTNF
SCHEMBL30180967 0.85 NLRP3 (0.74) NLRP3KCNH2IL1BTNF
SCHEMBL24855752 0.85 NLRP3 (0.74) NLRP3KCNH2IL1BTNF
SCHEMBL24855753 0.85 NLRP3 (0.74) NLRP3KCNH2IL1BTNF
SCHEMBL24855438 0.85 NLRP3 (0.74) NLRP3KCNH2IL1BTNF
SCHEMBL30181196 0.85 NLRP3 (0.74) NLRP3KCNH2IL1BTNF
SCHEMBL30181078 0.85 NLRP3 (0.74) NLRP3KCNH2IL1BTNF
SCHEMBL30356551 0.85 NLRP3 (0.74) NLRP3KCNH2IL1BTNF

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
WO-2023066377-A1 NITROGEN-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 索智生物科技(浙江)有限公司 2023-04-27 WO disclosed