SCHEMBL26436142

SCHEMBL26436142

Cc1cc(C(F)(F)F)cc(O)c1-c1nnc(NC2CC(C)(O)C2)c2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IL1B P01584 18/20 0.67
TNF P01375 3/20 0.67
NLRP3 Q96P20 2/20 0.55

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
SCHEMBL24574789 1.00 IL1B (0.67) IL1BTNFNLRP3
SCHEMBL24574798 0.91 IL1B (0.57) IL1BTNFNLRP3
SCHEMBL31280946 0.91 IL1B (0.57) IL1BTNFNLRP3
SCHEMBL24574757 0.89 IL1B (0.62) IL1BTNFNLRP3
SCHEMBL26435640 0.88 IL1B (0.61) IL1BTNFNLRP3
SCHEMBL26436038 0.88 IL1B (0.64) IL1BTNFNLRP3
SCHEMBL26434881 0.88 IL1B (0.49) IL1BTNFNLRP3
SCHEMBL26435055 0.87 IL1B (0.53) IL1BTNFNLRP3
SCHEMBL26436144 0.86 IL1B (0.59) IL1BTNFNLRP3
SCHEMBL24574826 0.86 NLRP3 (0.70) IL1BTNFNLRP3

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