SCHEMBL6573573

SCHEMBL6573573

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nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PDE4A P27815 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
USP2 O75604 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
AKR1B1 P15121 1/20 0.31
KDM4E B2RXH2 2/20 0.31

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
SCHEMBL8325036 1.00 LMNA (0.34) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL873892 0.95 LMNA (0.38) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL5829662 0.95 LMNA (0.38) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL3418340 0.93 LMNA (0.37) LMNAL3MBTL1PDE4ATDP1USP2
Alcohol SCHEMBL15066415 0.92 LMNA (0.35) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL18341352 0.89 AKR1B1 (0.33) AKR1B1
SCHEMBL4274454 0.86 TSHR (0.34) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL4272338 0.86 TSHR (0.34) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL4280281 0.86 TSHR (0.34) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL4274462 0.86 TSHR (0.34) LMNAL3MBTL1PDE4ATDP1USP2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1009377-A4 MEDICAL USES OF PYRUVATES UNIV CASE WESTERN RESERVE (US) 2004-01-21 EP disclosed
US-6086789-A SKIN INJURIES CASE WESTERN RESERVE UNIVERSITY (US) 2000-07-11 US disclosed
EP-1009377-A1 MEDICAL USES OF PYRUVATES Case Western Reserve University (US) 2000-06-21 EP disclosed
WO-1998051277-A1 MEDICAL USES OF PYRUVATES CASE WESTERN RESERVE UNIVERSITY (US) 1998-11-19 WO disclosed