SCHEMBL5988073

SCHEMBL5988073

O=C(O)c1ccccc1-c1ccc(-c2cnc(N(Cc3ccc(C(F)(F)P(=O)(O)O)c(Br)c3)c3ccc(F)cc3)o2)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.40
PTPN2 P17706 3/20 0.40
LTB4R2 Q9NPC1 6/20 0.40
BRS3 P32247 4/20 0.38
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
LPAR1 Q92633 1/20 0.35

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
SCHEMBL5988326 0.95 PTPN1 (0.40) PTPN1PTPN2LTB4R2BRS3NPC1
SCHEMBL5510851 0.93 PTPN1 (0.39) PTPN1PTPN2LTB4R2BRS3NPC1
SCHEMBL5503912 0.90 PTPN1 (0.38) PTPN1PTPN2LTB4R2BRS3NPC1
SCHEMBL5507775 0.86 PTPN1 (0.38) PTPN1PTPN2NPC1GAARAB9A
SCHEMBL5499270 0.86 PTPN1 (0.44) PTPN1PTPN2
SCHEMBL5508476 0.85 LTB4R2 (0.40) PTPN1LTB4R2BRS3NPC1GAA
SCHEMBL5499218 0.85 PTPN1 (0.37) PTPN1PTPN2NPC1GAARAB9A
SCHEMBL5499376 0.84 PTPN1 (0.39) PTPN1PTPN2
SCHEMBL5502408 0.84 PTPN1 (0.42) PTPN1PTPN2
SCHEMBL5500754 0.82 PTPN1 (0.37) PTPN1PTPN2LTB4R2BRS3RAB9A

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-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 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-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases PTPRO, PTPRG, PTPN1 PTPN1 3/4885PTPN2 24/4885LTB4R2 2923/4885

“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.