SCHEMBL13077873

SCHEMBL13077873

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

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 10/20 0.34
PTPN2 P17706 3/20 0.33
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
ESRRG P62508 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
SCHEMBL13078204 0.88 PTPN1 (0.37) PTPN1PTPN2
SCHEMBL3735415 0.88 HTR2A (0.35) PTPN1PTPN2ALDH1A1ESRRG
SCHEMBL13850697 0.86 PTPN1 (0.35) PTPN1PTPN2ESRRG
SCHEMBL3735481 0.83 PTPN1 (0.44) PTPN1PTPN2ALDH1A1LMNAMAPT
SCHEMBL3737652 0.83 PTPN1 (0.36) PTPN1PTPN2ESRRG
SCHEMBL3800605 0.82 PTPN1 (0.39) PTPN1PTPN2
SCHEMBL3743053 0.81 PTPN1 (0.38) PTPN1PTPN2MAPT
Hydrochloric Acid SCHEMBL3800600 0.81 PTPN1 (0.38) PTPN1PTPN2LMNAMAPT
SCHEMBL7188073 0.81 PTPN1 (0.36) PTPN1PTPN2
SCHEMBL3745490 0.81 ESRRG (0.48) PTPN1PTPN2LMNAMAPTESRRG

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7829737-B2 Protein tyrosine phosphatase inhibitors and methods of use thereof CEPTYR, INC. (US) 2010-11-09 US disclosed
US-20090131374-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CEPTYR, INC. (US) 2009-05-21 US disclosed
US-7504389-B2 Protein tyrosine phosphatase inhibitors and methods of use thereof CEPTYR, INC. (US) 2009-03-17 US disclosed
US-20080161592-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CEPTYR, INC. (US) 2008-07-03 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 (2 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-20080161592-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PPM1B, PTPN1, PTPN5 PTPN1 2/4885PTPN2 5/4885ALDH1A1 765/4885
US-20090131374-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PPM1B, PTPN1, PTPN5 PTPN1 2/4885PTPN2 5/4885ALDH1A1 765/4885

“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.