SCHEMBL13850697

SCHEMBL13850697

CCOP(=O)(OCC)C(F)(F)c1ccc(CCNCl)cc1Br

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 12/20 0.35
PTPN2 P17706 4/20 0.34
ESRRG P62508 1/20 0.31
NOTUM Q6P988 1/20 0.31
PTPRC P08575 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL13078004 0.88 PTPN1 (0.38) PTPN1PTPN2ESRRGNOTUMPTPRC
SCHEMBL3735415 0.88 HTR2A (0.35) PTPN1PTPN2ESRRGNOTUM
SCHEMBL13077873 0.86 PTPN1 (0.34) PTPN1PTPN2ESRRG
SCHEMBL7188073 0.85 PTPN1 (0.36) PTPN1PTPN2PTPRC
SCHEMBL3735481 0.85 PTPN1 (0.44) PTPN1PTPN2ESRRG
SCHEMBL7182085 0.84 PTPN1 (0.37) PTPN1PTPN2NOTUMPTPRC
SCHEMBL3800605 0.84 PTPN1 (0.39) PTPN1PTPN2
Hydrochloric Acid SCHEMBL3800600 0.83 PTPN1 (0.38) PTPN1PTPN2
SCHEMBL3745490 0.82 ESRRG (0.48) PTPN1PTPN2ESRRGHRH3
SCHEMBL3737652 0.82 PTPN1 (0.36) PTPN1PTPN2ESRRGNOTUM

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-20090131374-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CEPTYR, INC. (US) 2009-05-21 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-20090131374-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PPM1B, PTPN1, PTPN5 PTPN1 2/4885PTPN2 5/4885ESRRG 2947/4885

“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.