SCHEMBL26210944

SCHEMBL26210944

COC(=O)[C@@H]1CCCCN1C(=O)[C@H](C)Cc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.46
FKBP1A P62942 3/20 0.46
TSHR P16473 1/20 0.45
DPP7 Q9UHL4 2/20 0.44
LTA4H P09960 3/20 0.44
MMP1 P03956 1/20 0.44
MMP3 P08254 1/20 0.44
MMP13 P45452 1/20 0.44
ADAM17 P78536 1/20 0.44
KMT2A Q03164 1/20 0.44
DPP4 P27487 1/20 0.43
FAP Q12884 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
ACE P12821 1/20 0.43

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
SCHEMBL26210945 0.88 DPP4 (0.58) ALDH1A1HPGDDPP7DPP4FAP
SCHEMBL15828140 0.85 ACE (0.58) FKBP1ALTA4HACE
SCHEMBL15223617 0.85 ACE (0.58) FKBP1ALTA4HACE
SCHEMBL18085981 0.85 ACE (0.58) FKBP1ALTA4HACE
Trifluoroacetic Acid SCHEMBL30574548 0.82 DPP4 (0.53) DPP7DPP4FAPDPP8DPP9
SCHEMBL26211357 0.82 ENPP2 (0.43) ALDH1A1FKBP1ATSHR
SCHEMBL26439510 0.82 ENPP2 (0.43) ALDH1A1FKBP1ATSHR
SCHEMBL26218268 0.81 KLK5 (0.54) KMT2AACE
SCHEMBL26210824 0.80 CYP3A4 (0.47) ALDH1A1KMT2ADPP4
SCHEMBL26210873 0.79 ATM (0.44) DPP4

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-20230278996-A1 YKL-40 INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS MOLECURE S.A. (PL) 2023-09-07 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-20230278996-A1 YKL-40 INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS CHI3L1, CHI3L2, CHIA ALDH1A1 4771/4885HPGD 3407/4885FKBP1A 2322/4885

“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.