SCHEMBL6742617

SCHEMBL6742617

O=C(O)c1ccc(-c2ccc(C=C3SC(=S)N(c4ccccc4)C3=O)o2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN12 Q05209 1/20 0.77
PTPN22 Q9Y2R2 1/20 0.77
STAT3 P40763 1/20 0.68
MAP3K5 Q99683 1/20 0.64
DUSP22 Q9NRW4 3/20 0.64
INSR P06213 1/20 0.60
IGF1R P08069 1/20 0.60
POLB P06746 5/20 0.59
ALDH1A1 P00352 2/20 0.59
MAPT P10636 2/20 0.59
RAB9A P51151 2/20 0.59
LMNA P02545 1/20 0.59
PSMB8 P28062 3/20 0.59
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
KDM4E B2RXH2 1/20 0.58
THRB P10828 1/20 0.58
MAPK1 P28482 1/20 0.58
DNMT1 P26358 2/20 0.56

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
SCHEMBL46216 1.00 PTPN12 (0.77) PTPN12PTPN22STAT3MAP3K5DUSP22
SCHEMBL6790545 0.96 PTPN12 (0.77) PTPN12PTPN22STAT3MAP3K5DUSP22
SCHEMBL6790996 0.91 PTPN12 (0.76) PTPN12PTPN22STAT3MAP3K5DUSP22
SCHEMBL7642310 0.91 PTPN12 (0.76) PTPN12PTPN22STAT3MAP3K5DUSP22
SCHEMBL6784443 0.91 PTPN12 (0.76) PTPN12PTPN22STAT3MAP3K5DUSP22
SCHEMBL6785177 0.91 PTPN12 (0.76) PTPN12PTPN22STAT3MAP3K5DUSP22
SCHEMBL3896590 0.90 PTPN12 (0.67) PTPN12PTPN22STAT3MAP3K5DUSP22
SCHEMBL3896586 0.90 PTPN12 (0.67) PTPN12PTPN22STAT3MAP3K5DUSP22
SCHEMBL3895627 0.90 POLB (0.72) PTPN12PTPN22STAT3MAP3K5POLB
SCHEMBL3895634 0.90 POLB (0.72) PTPN12PTPN22STAT3MAP3K5POLB

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-20040002526-A1 Phospholipase D inhibitors and uses thereof CELL THERAPEUTICS, INC. 2004-01-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040002526-A1 Phospholipase D inhibitors and uses thereof PLD2, PLD1, PLA2G2D PTPN12 1169/4885PTPN22 1069/4885STAT3 1493/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.