SCHEMBL7065002

SCHEMBL7065002

COC(=O)C(Cc1ccc(N)c2ccccc12)NC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 7/20 0.48
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HCRTR1 O43613 1/20 0.46
ATM Q13315 1/20 0.44
OPRK1 P41145 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CACNA1C Q13936 1/20 0.41
SCN9A Q15858 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41

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
SCHEMBL7059635 0.88 ERAP2 (0.48) TACR1PTPN1
SCHEMBL6495441 0.84 TACR1 (0.51) TACR1SCN9ATP53MAPT
SCHEMBL11027962 0.81 TACR1 (0.69) TACR1MEN1KMT2AATMOPRK1
SCHEMBL11027965 0.81 TACR1 (0.69) TACR1MEN1KMT2AATMOPRK1
SCHEMBL7065183 0.77 PTPN1 (0.64) MEN1KMT2APTPN1ALDH1A1
SCHEMBL6504039 0.77 TACR1 (0.42) TACR1MEN1KMT2AHCRTR1ATM
SCHEMBL19355121 0.76 OPRK1 (0.52) TACR1KMT2AATMOPRK1ALDH1A1
SCHEMBL3184939 0.75 KMT2A (0.71) TACR1MEN1KMT2AHCRTR1ALDH1A1
SCHEMBL29401459 0.75 KMT2A (0.71) TACR1MEN1KMT2AHCRTR1ALDH1A1
SCHEMBL468840 0.75 KMT2A (0.71) TACR1MEN1KMT2AHCRTR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313696-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2003-05-28 EP disclosed
US-20020035137-A1 Amino (oxo) acetic acid protein tyrosine phosphatase inhibitors ABBOTT LABORATORIES 2002-03-21 US disclosed
WO-2002018323-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2002-03-07 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 (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-20020035137-A1 Amino (oxo) acetic acid protein tyrosine phosphatase inhibitors PPM1A, PTPRO, PTP4A1 TACR1 2750/4885MEN1 3065/4885KMT2A 3246/4885

“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.