SCHEMBL8575618

SCHEMBL8575618

OCCCc1ccc(-c2cccs2)s1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.67
LTA4H P09960 1/20 0.59
ALDH1A1 P00352 5/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
KDM4E B2RXH2 4/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 3/20 0.44
GLA P06280 2/20 0.44
MAPT P10636 2/20 0.44
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
HPGD P15428 3/20 0.42
HSD17B10 Q99714 3/20 0.42
MAPK1 P28482 2/20 0.42
MEN1 O00255 2/20 0.42
POLB P06746 2/20 0.42
CASP1 P29466 2/20 0.42
CASP7 P55210 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42

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
SCHEMBL499162 0.88 DPP4 (0.74) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL28000382 0.83 LTA4H (0.69) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL2585296 0.83 LTA4H (0.59) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL799475 0.83 LTA4H (0.59) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL26625918 0.82 LTA4H (0.73) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL406832 0.82 DPP4 (0.96) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL28000574 0.81 LTA4H (0.67) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL799496 0.81 DPP4 (0.60) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL28115589 0.81 LTA4H (0.67) DPP4LTA4HALDH1A1L3MBTL1KDM4E
SCHEMBL28000557 0.81 DPP4 (0.60) DPP4LTA4HALDH1A1L3MBTL1KDM4E

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-5753692-A PLANT EXTRACTS, IMMUNOSTIMULANTS TREATING IMMUNODEFICIENCY DISEASES INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1998-05-19 US disclosed
US-5747525-A ANTITUMOR AGENTS OF OLIGOMERS OF THIOPHENE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1998-05-05 US disclosed
US-5602170-A ADMINISTERING ANTIIFLAMMATORY AGENT INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1997-02-11 US disclosed