SCHEMBL9258089

SCHEMBL9258089

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nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
MAPT P10636 1/20 0.39
PTGS1 P23219 1/20 0.39
TP53 P04637 1/20 0.38
HSD17B10 Q99714 1/20 0.35
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
SLC7A5 Q01650 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL9266439 1.00 ALDH1A1 (0.39) ALDH1A1MAPTPTGS1TP53HSD17B10
SCHEMBL8608903 1.00 ALDH1A1 (0.39) ALDH1A1MAPTPTGS1TP53HSD17B10
SCHEMBL13685294 0.77 TET2 (0.31) ALDH1A1MAPTPTGS1
SCHEMBL9520079 0.77 ALDH1A1 (0.39) ALDH1A1MAPTPTGS1TP53HSD17B10
SCHEMBL11670627 0.76 ALDH1A1 (0.39) ALDH1A1MAPTPTGS1TP53HSD17B10
SCHEMBL1424635 0.72 ALDH1A1 (0.39) ALDH1A1MAPTPTGS1TP53TSHR
SCHEMBL15952106 0.72
SCHEMBL15952105 0.72
SCHEMBL11173637 0.72 ALDH1A1 (0.36) ALDH1A1MAPTPTGS1TP53HSD17B10
SCHEMBL9422547 0.71 ACACB (0.32) TSHR

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
US-5455262-A Treating arthritis, tumor metastasis, periodontal disease, corneal ulceration, bone resorption diseases, glomerular diseases FLORIDA STATE UNIVERSITY (US) 1995-10-03 US disclosed