SCHEMBL30737597

SCHEMBL30737597

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

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 6/20 0.44
▸ CTSD P07339 4/20 0.44
▸ PDCD1LG2 Q9BQ51 1/20 0.43
▸ CD274 Q9NZQ7 1/20 0.43
▸ ECE1 P42892 3/20 0.42
▸ MME P08473 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ DPP4 P27487 1/20 0.37
▸ DPP8 Q6V1X1 1/20 0.37
▸ DPP9 Q86TI2 1/20 0.37
▸ PLA2G2A P14555 1/20 0.36
▸ PLA2G5 P39877 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL29426362 0.97 PDCD1LG2 (0.45) BACE1CTSDPDCD1LG2CD274ECE1
SCHEMBL29531923 0.97 PDCD1LG2 (0.45) BACE1CTSDPDCD1LG2CD274ECE1
Hydrochloric Acid SCHEMBL23404120 0.95 PDCD1LG2 (0.44) BACE1CTSDPDCD1LG2CD274ECE1
Hydrochloric Acid SCHEMBL23404112 0.95 PDCD1LG2 (0.44) BACE1CTSDPDCD1LG2CD274ECE1
SCHEMBL30390006 0.92 CD274 (0.52) BACE1CTSDPDCD1LG2CD274ECE1
SCHEMBL29697048 0.92 CD274 (0.49) BACE1CTSDPDCD1LG2CD274ECE1
SCHEMBL25460023 0.90 ALDH1A1 (0.46) BACE1CTSDALDH1A1
SCHEMBL31720964 0.90 ENPEP (0.44) CTSDALDH1A1
SCHEMBL30737622 0.89 ECE1 (0.56) BACE1CTSDPDCD1LG2CD274ECE1
SCHEMBL29630774 0.89 ECE1 (0.56) BACE1CTSDPDCD1LG2CD274ECE1

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-20230355737-A1 PARTICLE COMPRISING AN RSV-F PROTEIN FOR USE IN RSV VACCINATION VIROMETIX AG (CH) 2023-11-09 — — 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-20230355737-A1 PARTICLE COMPRISING AN RSV-F PROTEIN FOR USE IN RSV VACCINATION CUTA, RRP12, VAC14 BACE1 1329/4885CTSD 2243/4885PDCD1LG2 829/4885

“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.

Send feedback