SCHEMBL21853695

SCHEMBL21853695

NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)CNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 14/20 0.41
MMP2 P08253 1/20 0.36
MMP8 P22894 1/20 0.36
MMP12 P39900 1/20 0.36
BMP1 P13497 2/20 0.36
NOD1 Q9Y239 1/20 0.35

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
SCHEMBL20133400 0.84 FOLH1 (0.44) FOLH1NOD1
SCHEMBL14300277 0.83 FOLH1 (0.44) FOLH1MMP2MMP8MMP12NOD1
SCHEMBL24618746 0.71 BMP1 (0.51) FOLH1MMP8BMP1
SCHEMBL20133399 0.71 QRFPR (0.43) FOLH1NOD1
SCHEMBL26440808 0.68 FOLH1 (0.42) FOLH1
SCHEMBL15295145 0.68 FOLH1 (0.49) FOLH1
SCHEMBL31429648 0.68 SMN1; SMN2 (0.42) FOLH1
SCHEMBL23636363 0.67 CYP2C19 (0.45)
SCHEMBL26504875 0.67 FOLH1 (0.48) FOLH1
SCHEMBL23790343 0.67 FOLH1 (0.67) 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-20200108159-A1 RADIOTHERAPEUTIC AND COMPANION IMAGING AGENTS TO TARGET MC1R WAKE FOREST UNIVERSITY 2020-04-09 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-20200108159-A1 RADIOTHERAPEUTIC AND COMPANION IMAGING AGENTS TO TARGET MC1R MC1R, MC3R, MC5R FOLH1 82/4885MMP2 4145/4885MMP8 2520/4885

“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.