SCHEMBL7681610

SCHEMBL7681610

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nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.33
LMNA P02545 2/20 0.33
PDE4A P27815 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
USP2 O75604 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
AKR1B1 P15121 1/20 0.30
TSHR P16473 1/20 0.30

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
Acetic Acid SCHEMBL10786614 0.94 LMNA (0.39) TDP1LMNAPDE4A
SCHEMBL9468059 0.90 TDP1 (0.32) TDP1LMNAPDE4AL3MBTL1USP2
Acetic Acid SCHEMBL10783619 0.90 LMNA (0.36) LMNA
SCHEMBL4606281 0.89
SCHEMBL4606284 0.89
SCHEMBL11692478 0.89 PDE4A (0.31) LMNAPDE4AL3MBTL1
SCHEMBL4651155 0.88
SCHEMBL5167233 0.88 TDP1 (0.34) TDP1AKR1B1TSHR
SCHEMBL4268170 0.88 TDP1 (0.34) TDP1AKR1B1TSHR
SCHEMBL7068618 0.87 LMNA (0.37) TDP1LMNAPDE4AL3MBTL1USP2

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-6380168-B1 ADMINISTERING 3-O-.BETA.-GLUCOPYRANOSYL(1-6)-.BETA.-D-GLUCOPYRANOSYL INDOLE, 2-S-.BETA.-D-GLUCOPYRANOSYL-3-O-.BETA.-D-GLUCOPYRANOSYL-2-MERC APTOINDOLE FOR INCREASING BLOOD FLOW TO SKIN NOMURA CO., LTD. (JP) 2002-04-30 US disclosed
US-6297363-B1 3-O-BETA-D-GLUCOPYRANOSYL(1-6)-BETA-D-GLUCOPYRANOSYL INDOLE; ISOLATED FROM CALANTHE DISCOLOR LINDL; FOR PROMOTION OF HAIR GROWTH AND RESTORATION NOMURA CO., LTD. (JP) 2001-10-02 US disclosed