SCHEMBL19754087

SCHEMBL19754087

O=C(O)CCCNC(=O)NC(CCCNC(=O)Cc1ccc(I)cc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 17/20 0.67
▸ ALB P02768 2/20 0.54
▸ ATM Q13315 1/20 0.53

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
SCHEMBL19754090 0.89 ATM (0.53) FOLH1ALBATM
SCHEMBL19743111 0.89 FOLH1 (0.72) FOLH1ALB
SCHEMBL19743110 0.89 FOLH1 (0.72) FOLH1ALB
SCHEMBL19748291 0.88 FOLH1 (0.69) FOLH1ALB
SCHEMBL19748432 0.84 FOLH1 (0.59) FOLH1
SCHEMBL19748972 0.80 FOLH1 (0.68) FOLH1ALB
SCHEMBL22247625 0.80 FOLH1 (0.62) FOLH1ALB
SCHEMBL19747822 0.79 FOLH1 (0.70) FOLH1ALB
SCHEMBL9903622 0.79 FOLH1 (0.74) FOLH1
SCHEMBL2475977 0.79 FOLH1 (0.74) FOLH1

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-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 (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-20170368005-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL PSMA2, FOLH1, KLK3 FOLH1 2/4885ALB 1812/4885ATM 2203/4885

“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.

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