SCHEMBL5606497

SCHEMBL5606497

Cc1cccc(C(=O)NCc2ccc(CC(N)C(=O)O)cc2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.62
CA2 P00918 1/20 0.62
SLC7A5 Q01650 5/20 0.57
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.52
ITGB3 P05106 1/20 0.50
ITGAV P06756 1/20 0.50
ITGA2B P08514 1/20 0.50
POLB P06746 1/20 0.50
PPARG P37231 2/20 0.49
ATM Q13315 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
NR1H4 Q96RI1 2/20 0.48
EPHX2 P34913 1/20 0.48
ALPI P09923 1/20 0.48
PKM P14618 1/20 0.48
PTGS1 P23219 1/20 0.48
XIAP P98170 1/20 0.48

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
SCHEMBL5606488 1.00 CA1 (0.62) CA1CA2SLC7A5RAB9ANPC1
SCHEMBL5607171 0.85 SLC7A5 (0.55) CA1CA2SLC7A5RAB9ANPC1
SCHEMBL5607177 0.85 SLC7A5 (0.55) CA1CA2SLC7A5RAB9ANPC1
SCHEMBL5607088 0.85 SLC7A5 (0.62) SLC7A5PPARGHDAC2HDAC8HDAC6
SCHEMBL5082554 0.85 SLC7A5 (0.62) SLC7A5PPARGHDAC2HDAC8HDAC6
SCHEMBL5607599 0.85 MEN1 (0.59) SLC7A5ITGB3ITGAVITGA2BPPARG
SCHEMBL5607029 0.85 EPHX2 (0.68) SLC7A5PPARGHDAC2HDAC8HDAC6
SCHEMBL5607824 0.85 ITGB3 (0.68) SLC7A5RAB9ANPC1ITGB3ITGAV
SCHEMBL5607609 0.85 MEN1 (0.59) SLC7A5ITGB3ITGAVITGA2BPPARG
SCHEMBL5607035 0.85 EPHX2 (0.68) SLC7A5PPARGHDAC2HDAC8HDAC6

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-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-10-11 US claimed

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-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS GLP1R, GIPR, IAPP CA1 4129/4885CA2 3196/4885SLC7A5 2674/4885

“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.