SCHEMBL27558196

SCHEMBL27558196

O=C(O)c1c(NC2CCCCO2)sc2c1CCS(O)(O)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 9/20 0.43
PTPRC P08575 2/20 0.36
PTPN2 P17706 2/20 0.36
PTPRB P23467 2/20 0.36
PTPRE P23469 2/20 0.36
PTPN6 P29350 1/20 0.36
KMT2A Q03164 4/20 0.36
NOD1 Q9Y239 1/20 0.36
POLB P06746 2/20 0.35
CASP6 P55212 1/20 0.35
MEN1 O00255 2/20 0.34
HPGD P15428 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
TSHR P16473 1/20 0.33
MAPK10 P53779 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL6402782 0.89 PTPN1 (0.57) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL7693899 0.83 PTPN1 (0.53) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL7854135 0.80 PTPN1 (0.58) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL7688988 0.79 PTPN1 (0.55) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL4449756 0.79 PTPN1 (0.55) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL7855098 0.79 PTPN2 (0.58) PTPN1PTPN2KMT2ANOD1POLB
SCHEMBL6399832 0.77 PTPN1 (0.39) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL7562771 0.75 PTPN1 (0.35) PTPN1PTPRCPTPN2PTPRBPTPRE
SCHEMBL7855558 0.75 KMT2A (0.53) PTPN1PTPN2KMT2ANOD1POLB
SCHEMBL7696216 0.71 GRM1 (0.48) PTPN1PTPN2KMT2ANOD1POLB

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
CN-1300291-A Modulators of protein tyrosine phosphatases (PTP enzymes) NOVO NORDISK AS (DK) 2001-06-20 CN claimed
CN-1300291-A Modulators of protein tyrosine phosphatases (PTP enzymes) NOVO NORDISK AS (DK) 2001-06-20 CN disclosed