SCHEMBL8607208

SCHEMBL8607208

CCCCC1=C[N]c2ccccc2C1=S

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.36
CNR1 P21554 3/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TLR8 Q9NR97 4/20 0.33
KCNH2 Q12809 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
POLB P06746 1/20 0.32
PSMB5 P28074 1/20 0.31
PARP1 P09874 1/20 0.31
TLR7 Q9NYK1 1/20 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
SCHEMBL6529249 0.86 PTPN1 (0.39) PTPN1CNR1KDM4EALDH1A1TLR8
SCHEMBL6706314 0.75 KDM4E (0.33) PTPN1KDM4EALDH1A1
SCHEMBL15733045 0.69 PTPN1 (0.54) PTPN1ALDH1A1MEN1KMT2A
SCHEMBL15732842 0.65 PTPN1 (0.60) PTPN1CNR1
SCHEMBL15732974 0.64 PTPN1 (0.63) PTPN1CNR1
SCHEMBL15733081 0.64 PTPN1 (0.63) PTPN1CNR1
SCHEMBL15732985 0.64 PTPN1 (0.63) PTPN1CNR1
SCHEMBL9754870 0.63 ALDH1A1 (0.39) KDM4EALDH1A1
SCHEMBL10608915 0.62 PTPN1 (0.50) PTPN1CNR1ALDH1A1
SCHEMBL5602078 0.62 KDM4E (0.33) PTPN1KDM4EALDH1A1TLR8KCNH2

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-5741794-A PLATELET ACTIVATING FACTOR BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1998-04-21 US disclosed
EP-0620813-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS ANTAGONISTS OF PAF AND ANGIOTENSIN II BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-10-26 EP disclosed
WO-1993014069-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS ANTAGONISTS OF PAF AND ANGIOTENSIN II BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-07-22 WO disclosed