SCHEMBL31369665

SCHEMBL31369665

CS(=O)(=O)N1CCN(c2ccc(C[C@H](N)C(=O)O)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.48
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
AOC3 Q16853 1/20 0.43
TLR7 Q9NYK1 1/20 0.42
HSD17B10 Q99714 2/20 0.42
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GPR119 Q8TDV5 3/20 0.40
DGAT1 O75907 1/20 0.40
AKT1 P31749 1/20 0.40
SLC7A5 Q01650 1/20 0.40
ACACB O00763 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL31370121 0.85 HSD17B10 (0.46) RORCKDM4ERAB9AAOC3HSD17B10
SCHEMBL26966077 0.84 AOC3 (0.58) RORCAOC3HSD17B10ALDH1A1GAA
SCHEMBL26966436 0.84 AOC3 (0.58) RORCAOC3HSD17B10ALDH1A1GAA
SCHEMBL31688612 0.83 AOC3 (0.54) KDM4EAOC3HSD17B10LMNAALDH1A1
SCHEMBL20425015 0.82 RORC (0.49) RORCKDM4ENPC1RAB9AAOC3
SCHEMBL31370373 0.81 HSD17B10 (0.46) KDM4EAOC3TLR7HSD17B10AKT1
SCHEMBL31370169 0.81 AOC3 (0.56) KDM4ENPC1RAB9AAOC3HSD17B10
SCHEMBL34468285 0.81 HSD17B10 (0.46) KDM4EAOC3TLR7HSD17B10AKT1
SCHEMBL31369460 0.80 WNT3A (0.53) KDM4EAOC3HSD17B10LMNAAKT1
SCHEMBL31688502 0.77 TDO2 (0.47) RORCHSD17B10ALDH1A1L3MBTL1GPR119

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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 RORC 3091/4885KDM4E 3586/4885NPC1 4533/4885

“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.