SCHEMBL8567080

SCHEMBL8567080

[c]1ccc(SNc2ccc(-c3ccccc3)nc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
LDHA P00338 1/20 0.37
BAZ2B Q9UIF8 1/20 0.36
WNT3A P56704 7/20 0.36
USP30 Q70CQ3 1/20 0.34
CYP11B1 P15538 5/20 0.34
CYP11B2 P19099 5/20 0.34
HPGDS O60760 2/20 0.34

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
SCHEMBL28590572 0.71 HPGDS (0.49) PTPN2PTPN1LDHABAZ2BCYP11B1
SCHEMBL28599514 0.71 HPGDS (0.49) PTPN2PTPN1LDHABAZ2BCYP11B1
SCHEMBL9057614 0.69 BAZ2B (0.53) PTPN2PTPN1LDHABAZ2BWNT3A
SCHEMBL22589209 0.69 ALDH1A1 (0.52) PTPN2PTPN1LDHABAZ2BWNT3A
SCHEMBL27676919 0.69 PTPN2 (0.50) PTPN2PTPN1LDHABAZ2BWNT3A
Hydrochloric Acid SCHEMBL23235071 0.67 PTPN2 (0.49) PTPN2PTPN1LDHABAZ2BWNT3A
SCHEMBL4870704 0.65 PTPN1 (0.67) PTPN2PTPN1LDHABAZ2BWNT3A
SCHEMBL27405407 0.65 TDP1 (0.50) PTPN2PTPN1LDHABAZ2BWNT3A
SCHEMBL8562167 0.65 GAA (0.45)
SCHEMBL28697805 0.64 HDAC4 (0.54) PTPN2PTPN1WNT3ACYP11B1CYP11B2

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-5814646-A TREATING THE PROGRESSION OF ALZHEIMER'S DISEASE, BRAIN DISORDERS ELI LILLY AND COMPANY (US) 1998-09-29 US disclosed