SCHEMBL29426614

SCHEMBL29426614

COC(=O)Cn1nc(C(C)C)c2cc(OC(F)(F)F)ccc2c1=O

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 3/20 0.47
▸ GPR139 Q6DWJ6 14/20 0.46
▸ TSHR P16473 1/20 0.45

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
SCHEMBL26732715 1.00 NLRP3 (0.47) NLRP3GPR139TSHR
SCHEMBL24077038 0.90 NLRP3 (0.47) NLRP3GPR139
SCHEMBL24077012 0.90 GAA (0.47) NLRP3GPR139
SCHEMBL29426561 0.89 NLRP3 (0.48) NLRP3GPR139TSHR
SCHEMBL26630479 0.89 NLRP3 (0.48) NLRP3GPR139TSHR
SCHEMBL30636643 0.88 NLRP3 (0.46) NLRP3GPR139
SCHEMBL29426566 0.85 NLRP3 (0.63) NLRP3GPR139TSHR
SCHEMBL26732911 0.85 NLRP3 (0.63) NLRP3GPR139TSHR
SCHEMBL26738768 0.85 TSHR (0.46) NLRP3GPR139TSHR
SCHEMBL26732740 0.82 NLRP3 (0.49) NLRP3GPR139TSHR

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
EP-4196125-A1 COMPOUNDS, COMPOSITIONS AND METHODS Denali Therapeutics Inc. (US) 2023-06-21 — — EP disclosed
WO-2022036204-A1 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. (US) 2022-02-17 — — WO disclosed
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