SCHEMBL4959762

SCHEMBL4959762

CS(=O)(=O)c1ccc(-c2csc(N(Cc3ccc(C(=O)O)cc3)Cc3ccc(CP(=O)(OF)OF)c(Br)c3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.39
NPC1 O15118 4/20 0.39
KDM4E B2RXH2 4/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 2/20 0.37
MEN1 O00255 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TRPM8 Q7Z2W7 2/20 0.35
HTT P42858 2/20 0.35
GAA P10253 1/20 0.35
GCGR P47871 4/20 0.34
GIPR P48546 4/20 0.34
PTPRB P23467 1/20 0.34
ENPP2 Q13822 1/20 0.34
PTPN1 P18031 2/20 0.34
PTPN2 P17706 1/20 0.34

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
SCHEMBL4954893 0.93 RAB9A (0.40) RAB9ANPC1KDM4EKMT2APOLB
SCHEMBL4956441 0.88 RAB9A (0.38) RAB9ANPC1KDM4EKMT2APOLB
SCHEMBL4957254 0.86 KDM4E (0.38) RAB9ANPC1KDM4EKMT2APOLB
SCHEMBL4955541 0.85 PTPRB (0.45) RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL4959280 0.83 GCGR (0.47) GCGRGIPR
SCHEMBL4959758 0.82 PTPN1 (0.49) RAB9ANPC1KDM4EKMT2APOLB
SCHEMBL4954927 0.81 KMT2A (0.45) RAB9ANPC1KDM4EKMT2APOLB
SCHEMBL4956610 0.79 PTPRB (0.47) RAB9AKDM4EKMT2AMEN1ALDH1A1
SCHEMBL4957713 0.79 GCGR (0.47) RAB9ANPC1KDM4EKMT2AMEN1
SCHEMBL4957357 0.79 GCGR (0.55) GCGRGIPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200371-A1 THIAZOLE AND THIADIAZOLE INHIBITORS OF TYROSINE PHOSPHATASES IMPINJ, INC. 2008-08-21 US claimed
EP-1841749-A1 DERIVATIVES OF THIAZOLE AND THIADIAZOLE INHIBITORS OF TYROSINE PHOSPHATASES Metabasis Therapeutics, Inc. (US) 2007-10-10 EP claimed
US-20060194768-A1 Thiazole and thiadiazole inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-08-31 US claimed
WO-2006028970-A1 DERIVATIVES OF THIAZOLE AND THIADIAZOLE INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-03-16 WO claimed
US-20080200371-A1 THIAZOLE AND THIADIAZOLE INHIBITORS OF TYROSINE PHOSPHATASES IMPINJ, INC. 2008-08-21 US disclosed
US-7381736-B2 Thiazole and thiadiazole inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. (US) 2008-06-03 US disclosed
EP-1841749-A1 DERIVATIVES OF THIAZOLE AND THIADIAZOLE INHIBITORS OF TYROSINE PHOSPHATASES Metabasis Therapeutics, Inc. (US) 2007-10-10 EP disclosed
US-20060194768-A1 Thiazole and thiadiazole inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-08-31 US disclosed
WO-2006028970-A1 DERIVATIVES OF THIAZOLE AND THIADIAZOLE INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-03-16 WO 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-20060194768-A1 Thiazole and thiadiazole inhibitors of tyrosine phosphatases PTPN1, PTPN5, PTPN18 RAB9A 2890/4885NPC1 4858/4885KDM4E 1051/4885
US-20080200371-A1 THIAZOLE AND THIADIAZOLE INHIBITORS OF TYROSINE PHOSPHATASES PTPN1, PTPN5, PTPN18 RAB9A 2890/4885NPC1 4858/4885KDM4E 1051/4885

“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.