SCHEMBL23752015

SCHEMBL23752015

C[C@H](NC(=O)O)C(=O)NN

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.42
CTSD P07339 1/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
ALDH1A1 P00352 2/20 0.32
DPP4 P27487 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
MME P08473 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31
ACE2 Q9BYF1 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
GAA P10253 1/20 0.31
CYP1A2 P05177 1/20 0.30
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL14831398 1.00 HIF1A (0.42) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL15914159 1.00 HIF1A (0.42) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL20740993 0.95 HIF1A (0.39) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL20740996 0.95 HIF1A (0.39) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL19859539 0.81 HIF1A (0.39) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL16619229 0.81 HIF1A (0.39) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL19479440 0.80 HIF1A (0.42) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL14967166 0.80 HIF1A (0.42) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL11428513 0.80 HIF1A (0.42) HIF1ACTSDCA1CA2ALDH1A1
SCHEMBL21335951 0.78 HIF1A (0.40) HIF1ACTSDCA1CA2ALDH1A1

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-20210253557-A1 SUBSTITUTED TRIAZOLE DERIVATIVES AND USES THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-08-19 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-20210253557-A1 SUBSTITUTED TRIAZOLE DERIVATIVES AND USES THEREOF GLS, TNNI3, CYP11B2 HIF1A 1354/4885CTSD 1535/4885CA1 4751/4885

“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.