SCHEMBL30052907

SCHEMBL30052907

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

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.41
▸ SLC7A5 Q01650 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ DPP4 P27487 1/20 0.40
▸ FAP Q12884 1/20 0.40
▸ DPP8 Q6V1X1 1/20 0.40
▸ DPP9 Q86TI2 1/20 0.40
▸ DPP7 Q9UHL4 1/20 0.40
▸ SDCBP O00560 3/20 0.38
▸ SDC2 P34741 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ EPHX2 P34913 1/20 0.37
▸ PLA2G2A P14555 1/20 0.36
▸ PLA2G5 P39877 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MBTPS1 Q14703 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
SCHEMBL29448573 0.97 DPP4 (0.41) NPSR1SLC7A5SMN1; SMN2DPP4FAP
SCHEMBL31129093 0.95 NPSR1 (0.38) NPSR1SLC7A5SMN1; SMN2DPP4FAP
SCHEMBL29551119 0.93 DPP4 (0.38) NPSR1SLC7A5SMN1; SMN2DPP4FAP
SCHEMBL30668291 0.91 DPP4 (0.39) NPSR1SLC7A5SMN1; SMN2DPP4FAP
SCHEMBL29421862 0.90 NPSR1 (0.39) NPSR1SMN1; SMN2SDCBPSDC2ALDH1A1
SCHEMBL29349612 0.88 ALDH1A1 (0.42) NPSR1SMN1; SMN2SDCBPSDC2ALDH1A1
SCHEMBL34464920 0.88 OPRD1 (0.38) SLC7A5DPP4FAPDPP8DPP9
SCHEMBL30051101 0.88 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1
SCHEMBL29448558 0.88 TERT (0.47) NPSR1SMN1; SMN2SDCBPSDC2ALDH1A1
SCHEMBL31588230 0.87 ALDH1A1 (0.43) SLC7A5DPP4FAPDPP8DPP9

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-12622975-B2 Peptide-conjugated prodrugs BRANDEIS UNIVERSITY (US) 2026-05-12 — — US disclosed
US-12139551-B2 Anti-IDO antibody and uses thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2024-11-12 — — US disclosed
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-12-08 — — 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-12622975-B2 Peptide-conjugated prodrugs PEPD, PAM, VIP NPSR1 2720/4885SLC7A5 247/4885SMN1; SMN2 4135/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD NPSR1 489/4885SLC7A5 439/4885SMN1; SMN2 3023/4885

“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