SCHEMBL25978155

SCHEMBL25978155

CCC(CC(=O)O)C(=O)NC(C)C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.46
LTA4H P09960 2/20 0.42
BIRC2 Q13490 1/20 0.41
USP2 O75604 1/20 0.40
TSHR P16473 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MMP2 P08253 5/20 0.40
MMP3 P08254 5/20 0.40
MMP1 P03956 3/20 0.40
MMP7 P09237 1/20 0.40
PDF Q9HBH1 1/20 0.40
BMP1 P13497 2/20 0.39
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL13609165 0.84 TSHR (0.54) BIRC2USP2TSHRALDH1A1MMP2
SCHEMBL21994104 0.82 MME (0.67) MMELTA4HALDH1A1MMP2MMP3
SCHEMBL25654468 0.78 MMP2 (0.45) USP2TSHRMMP2MMP3MMP1
SCHEMBL13768731 0.77 MME (0.45) MMEBIRC2MMP2MMP3MMP1
SCHEMBL18239031 0.77 MME (0.45) MMEBIRC2MMP2MMP3MMP1
SCHEMBL16279524 0.77 CA2 (0.57) MMEUSP2TSHRALDH1A1MMP2
SCHEMBL26992372 0.77 HDAC8 (0.50) USP2TSHR
SCHEMBL17321831 0.77 BIRC2 (0.45) MMEBIRC2USP2TSHRALDH1A1
SCHEMBL29400840 0.76 NAALAD2 (0.46) MMEBIRC2USP2TSHRALDH1A1
SCHEMBL9911498 0.76 MME (0.38) MMELTA4HTSHRALDH1A1MMP2

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-20230399356-A1 ANTIBODY DRUG CONJUGATES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-12-14 US disclosed
US-11725024-B2 Antibody drug conjugates TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-08-15 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-20230399356-A1 ANTIBODY DRUG CONJUGATES STING1, CGAS, TBK1 MME 3685/4885LTA4H 1291/4885BIRC2 1035/4885
US-11725024-B2 Antibody drug conjugates STING1, CGAS, TBK1 MME 3685/4885LTA4H 1291/4885BIRC2 1035/4885

“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.