SCHEMBL4008288

SCHEMBL4008288

CCOP(=O)(OCC)C(F)(F)c1cc(C(F)(F)F)ccc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.40
LMNA P02545 4/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 4/20 0.38
XBP1 P17861 1/20 0.38
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
POLQ O75417 1/20 0.35
PTPN2 P17706 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
CES2 O00748 1/20 0.34
TAS2R14 Q9NYV8 1/20 0.34
NPC1 O15118 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
PTPN1 P18031 2/20 0.34
DRD3 P35462 1/20 0.34
L3MBTL1 Q9Y468 2/20 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
SCHEMBL4009773 0.83 PTPN2 (0.35) NPSR1LMNAGAAMAPTMEN1
SCHEMBL3800715 0.83 PTPN1 (0.39) LMNAMAPTMEN1KMT2APTPN2
SCHEMBL3747185 0.82 PTPN1 (0.38) NPSR1LMNAGAAPTPN2PTPN1
SCHEMBL3741814 0.82 EPHX2 (0.38) GAAMAPTMEN1KMT2APTPN2
SCHEMBL3735793 0.81 PTPN1 (0.39) NPSR1LMNAMAPTMEN1KMT2A
SCHEMBL5506535 0.80 CA1 (0.41) NPSR1LMNAGAAHTTL3MBTL1
SCHEMBL4004235 0.78 PTPN1 (0.48) LMNAPTPN2PTPN1
SCHEMBL3802511 0.78 CA1 (0.36) PTPN2PTPN1DRD3
SCHEMBL3737637 0.75 PTPN1 (0.45) NPSR1LMNAGAAMAPTMEN1
SCHEMBL3738162 0.75 PGK1 (0.52) NPSR1MAPTXBP1PTPN2PTPN1

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
US-7504389-B2 Protein tyrosine phosphatase inhibitors and methods of use thereof CEPTYR, INC. (US) 2009-03-17 US disclosed
US-20060142250-A1 Protein tyrosine phosphatase inhibitors and methods of use thereof FALCON TECHNOLOGY PARTNERS L.P. 2006-06-29 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-20060142250-A1 Protein tyrosine phosphatase inhibitors and methods of use thereof PPM1B, PTPN1, PTPN5 NPSR1 3741/4885LMNA 4192/4885GAA 214/4885

“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.