SCHEMBL16322720

SCHEMBL16322720

CC(=O)C(CCCCNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1)NC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 15/20 0.48
ALB P02768 1/20 0.46
ALDH1A1 P00352 2/20 0.45

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
SCHEMBL29322556 0.89 NOD1 (0.51) FOLH1ALB
SCHEMBL17378269 0.84 FOLH1 (0.43) FOLH1ALBALDH1A1
SCHEMBL18659694 0.84 ALDH1A1 (0.45) FOLH1ALBALDH1A1
SCHEMBL16089032 0.83 FOLH1 (0.42) FOLH1ALBALDH1A1
SCHEMBL20882013 0.83 FOLH1 (0.52) FOLH1ALBALDH1A1
SCHEMBL26504875 0.82 FOLH1 (0.48) FOLH1ALB
SCHEMBL23824133 0.82 SMN1; SMN2 (0.49) FOLH1ALBALDH1A1
SCHEMBL18118446 0.82 FOLH1 (0.48) FOLH1ALB
SCHEMBL17246791 0.82 FOLH1 (0.53) FOLH1ALB
SCHEMBL17246432 0.82 FOLH1 (0.44) FOLH1ALBALDH1A1

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
US-20110229409-A1 LINKABLE LEWIS X ANALOGS BRACCO INTERNATIONAL B.V. (NL) 2011-09-22 US disclosed
US-20080300220-A1 Linkable Lewis X Analogs BRACCO INTERNATIONAL B.V. (NL) 2008-12-04 US disclosed
US-7422733-B2 Linkable sialyl Lewis X analogs BRACCO INTERNATIONAL B.V. (NL) 2008-09-09 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 (2 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-20080300220-A1 Linkable Lewis X Analogs SSB, SELPLG, SELL FOLH1 1521/4885ALB 1233/4885ALDH1A1 1758/4885
US-20110229409-A1 LINKABLE LEWIS X ANALOGS SELPLG, SELL, SELE FOLH1 3223/4885ALB 669/4885ALDH1A1 1892/4885

“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.