SCHEMBL8523856

SCHEMBL8523856

O=C1SC(OCCN2CCc3ccccc32)C(=O)N1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
USP2 O75604 1/20 0.44
CDK4 P11802 1/20 0.44
ALOX15 P16050 1/20 0.44
CCND1 P24385 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
POLB P06746 4/20 0.43
MAPT P10636 5/20 0.43
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 2/20 0.40
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD2 P14416 1/20 0.39

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
SCHEMBL8576596 0.78 CACNA1G (0.39) ALDH1A1POLBMAPTGAACHRM1
SCHEMBL8573201 0.77 POLB (0.37) ALDH1A1POLBMAPTGAACHRM1
SCHEMBL8572927 0.75 POLB (0.39) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL8575184 0.74 POLB (0.38) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL3774754 0.73 MAPT (0.50) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL8577715 0.73 POLB (0.35) ALDH1A1CDK4POLBMAPTL3MBTL1
SCHEMBL6032173 0.72 MAPT (0.54) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL8523852 0.72 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL8576765 0.72 POLB (0.36) ALDH1A1POLBMAPTL3MBTL1GAA
SCHEMBL8573028 0.72 POLB (0.36) ALDH1A1POLBMAPTL3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5834501-A TREATING DIABETES OR HYPERLIPEMIA SANKYO COMPANY, LIMITED (JP) 1998-11-10 US claimed
US-5962470-A Heterocyclic compounds having anti-diabetic activity and their use SANKYO COMPANY, LIMITED (JP) 1999-10-05 US disclosed
US-5739345-A HYPOGLYCEMIC AND ANTIDIABETIC AGENTS SANKYO COMPANY, LIMITED (JP) 1998-04-14 US disclosed