SCHEMBL7164802

SCHEMBL7164802

COC(=O)c1ccc(C(Cc2ccc(OC(F)(F)C(=O)OC(C)(C)C)cc2)(Cc2ccc(C(F)(F)P(=O)(OC(C)(C)C)OC(C)(C)C)cc2)C(=O)c2ccc(F)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.41
EPHX2 P34913 2/20 0.36
NR1H4 Q96RI1 1/20 0.36
PTPN2 P17706 2/20 0.36
PTPRC P08575 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ATM Q13315 1/20 0.34
USP30 Q70CQ3 1/20 0.34
CASR P41180 1/20 0.33
LMNA P02545 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL7167025 0.95 PTPN1 (0.42) PTPN1EPHX2NR1H4PTPN2PTPRC
SCHEMBL7164018 0.85 PTPN1 (0.49) PTPN1PTPN2PTPRCKMT2AMEN1
SCHEMBL6948156 0.82 PTPN1 (0.60) PTPN1PTPN2PTPRCKMT2AMEN1
SCHEMBL7162695 0.81 PTPN1 (0.57) PTPN1PTPN2PTPRCKMT2AMEN1
SCHEMBL7166675 0.80 PTPN1 (0.53) PTPN1PTPN2PTPRCNPC1RAB9A
SCHEMBL7169222 0.79 PTPN1 (0.60) PTPN1PTPN2PTPRCKMT2AMEN1
SCHEMBL7165643 0.79 PTPN1 (0.60) PTPN1PTPN2PTPRCKMT2AMEN1
SCHEMBL7167840 0.78 PTPN1 (0.65) PTPN1PTPN2PTPRCKMT2AMEN1
SCHEMBL7168579 0.78 PTPN1 (0.65) PTPN1PTPN2PTPRCKMT2AMEN1
SCHEMBL6948100 0.78 PTPN1 (0.69) PTPN1PTPN2PTPRC

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-6583126-B2 Treating diabetes, obesity, and diabetes-related diseases. MERCK EROSST CANADA & CO. 2003-06-24 US disclosed
US-20020052344-A1 Phosphonic acid derivatives as inhibitors of protein tyrosine phosphatase IB (PTP-IB) MERCK FROSST CANADA LTD. (CA) 2002-05-02 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-20020052344-A1 Phosphonic acid derivatives as inhibitors of protein tyrosine phosphatase IB (PTP-IB) PTPRO, PTPRC, PPM1B PTPN1 17/4885EPHX2 2077/4885NR1H4 2405/4885

“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.