SCHEMBL19743085

SCHEMBL19743085

O=C(O)CC[C@H](NC(=O)N[C@@H](CCC(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.92

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 11/20 0.92
CPB1 P15086 1/20 0.62
CPB2 Q96IY4 1/20 0.62
HTT P42858 1/20 0.58
MMP2 P08253 1/20 0.56
MMP9 P14780 1/20 0.56

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
SCHEMBL19743088 1.00 FOLH1 (0.92) FOLH1CPB1CPB2HTTMMP2
SCHEMBL18161459 0.96 FOLH1 (1.00) FOLH1CPB1CPB2HTTMMP2
SCHEMBL18145488 0.96 FOLH1 (1.00) FOLH1CPB1CPB2HTTMMP2
SCHEMBL19742200 0.96 FOLH1 (1.00) FOLH1CPB1CPB2HTTMMP2
SCHEMBL14729484 0.96 FOLH1 (1.00) FOLH1CPB1CPB2HTTMMP2
SCHEMBL19743114 0.92 FOLH1 (0.93) FOLH1CPB1CPB2HTTMMP2
SCHEMBL19743113 0.92 FOLH1 (0.93) FOLH1CPB1CPB2HTTMMP2
SCHEMBL25216970 0.90 FOLH1 (0.78) FOLH1CPB1CPB2HTTMMP2
SCHEMBL25195535 0.90 FOLH1 (0.78) FOLH1CPB1CPB2HTTMMP2
SCHEMBL29072085 0.89 FOLH1 (0.76) FOLH1CPB1CPB2HTTMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210137860-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL CORNELL UNIVERSITY (US) 2021-05-13 US disclosed
US-10716772-B2 Double targeted constructs to affect tumor kill CORNELL UNIVERSITY (US) 2020-07-21 US disclosed
US-20190142770-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL CORNELL UNIVERSITY 2019-05-16 US disclosed
US-10179117-B2 Double targeted constructs to affect tumor kill CORNELL UNIVERSITY (US) 2019-01-15 US disclosed
US-20170368005-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL CORNELL UNIVERSITY 2017-12-28 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 (5 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-20210137860-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL PSMA2, FOLH1, KLK3 FOLH1 2/4885CPB1 396/4885CPB2 130/4885
US-10716772-B2 Double targeted constructs to affect tumor kill PSMA2, FOLH1, KLK3 FOLH1 2/4885CPB1 396/4885CPB2 130/4885
US-20170368005-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL PSMA2, FOLH1, KLK3 FOLH1 2/4885CPB1 396/4885CPB2 130/4885
US-20190142770-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL PSMA2, FOLH1, KLK3 FOLH1 2/4885CPB1 396/4885CPB2 130/4885
US-10179117-B2 Double targeted constructs to affect tumor kill PSMA2, FOLH1, KLK3 FOLH1 2/4885CPB1 396/4885CPB2 130/4885

“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.