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)
SCHEMBL1892483 0.82 HDAC6 (0.50) NLRP3
SCHEMBL3511639 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 SCHEMBL6017679 0.67 NLRP3 (0.31) NLRP3
Taxusin SCHEMBL4990660 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