SCHEMBL21766754

SCHEMBL21766754

CCCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCNC(=O)c1ccc(C(=O)O)c(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c1)C(N)=O

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTRA2 O43464 8/20 0.60
HTRA1 Q92743 8/20 0.60
ALB P02768 2/20 0.60
FOLH1 Q04609 2/20 0.53
WDR5 P61964 1/20 0.50
ESR1 P03372 1/20 0.44

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
SCHEMBL21766490 0.86 WDR5 (0.58) HTRA2HTRA1ALBFOLH1WDR5
SCHEMBL21766803 0.86 WDR5 (0.61) HTRA2HTRA1ALBFOLH1WDR5
SCHEMBL21766805 0.85 WDR5 (0.63) HTRA2HTRA1ALBFOLH1WDR5
SCHEMBL23314226 0.84 ALB (0.61) HTRA2HTRA1ALBFOLH1WDR5
SCHEMBL21766701 0.84 WDR5 (0.54) HTRA2HTRA1ALBFOLH1WDR5
SCHEMBL21766752 0.84 HTRA2 (0.48) HTRA2HTRA1ALBFOLH1WDR5
SCHEMBL18162918 0.84 ALB (0.64) HTRA2HTRA1ALBFOLH1
SCHEMBL21766716 0.83 WDR5 (0.55) HTRA2HTRA1ALBFOLH1WDR5
SCHEMBL13286956 0.83 ALB (0.60) HTRA2HTRA1ALBFOLH1ESR1
SCHEMBL21766719 0.82 ALB (0.56) HTRA2HTRA1ALBFOLH1WDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10994017-B2 Nerve labeling compositions and uses thereof AVELAS BIOSCIENCES, INC. (US) 2021-05-04 US disclosed
US-20200061200-A1 NERVE LABELING COMPOSITIONS AND USES THEREOF AVELAS ACQUISITION CORPORATION 2020-02-27 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-20200061200-A1 NERVE LABELING COMPOSITIONS AND USES THEREOF GAP43, NGF, PMP22 HTRA2 2525/4885HTRA1 4086/4885ALB 2018/4885
US-10994017-B2 Nerve labeling compositions and uses thereof GAP43, NGF, PMP22 HTRA2 2525/4885HTRA1 4086/4885ALB 2018/4885

“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.