SCHEMBL3510752

SCHEMBL3510752

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nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 18/20 0.40
▸ USP2 O75604 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35

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
SCHEMBL4806029 0.84 HDAC6 (0.37) —
SCHEMBL3511639 0.82 HDAC6 (0.50) NLRP3
SCHEMBL1892483 0.82 HDAC6 (0.50) NLRP3
SCHEMBL29365073 0.73 USP2 (0.31) NLRP3USP2CYP3A4
SCHEMBL1891255 0.71 OPRK1 (0.33) NLRP3USP2CYP3A4
Hongdoushan B SCHEMBL15620125 0.69 NLRP3 (0.32) NLRP3
Taxusin SCHEMBL4990660 0.67 NLRP3 (0.31) NLRP3
Taxusin SCHEMBL6017679 0.67 NLRP3 (0.31) NLRP3
SCHEMBL713065 0.66 HDAC6 (0.59) —
SCHEMBL17590204 0.66 HDAC6 (0.59) —

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
US-20100297722-A1 TRANSGENIC MOSS PRODUCING TERPENOIDS BOARD OF TRUSTEES OF SOUTHERN ILLINOIS UNIVERSITY (US) 2010-11-25 — — US claimed
US-20100297722-A1 TRANSGENIC MOSS PRODUCING TERPENOIDS BOARD OF TRUSTEES OF SOUTHERN ILLINOIS UNIVERSITY (US) 2010-11-25 — — US disclosed
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