SCHEMBL23854882

SCHEMBL23854882

COCC(C)NC(=N)NC(=O)c1cc(C#N)ccc1O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TMPRSS4 Q9NRS4 3/20 0.41
EGLN1 Q9GZT9 4/20 0.40
HPGD P15428 4/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALOX5 P09917 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
POLB P06746 1/20 0.37
ATM Q13315 1/20 0.37
P2RX1 P51575 1/20 0.37
MAPK14 Q16539 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
SCHEMBL21884387 1.00 TMPRSS4 (0.41) TMPRSS4EGLN1HPGDMEN1KMT2A
SCHEMBL21884601 0.80 TMPRSS4 (0.44) TMPRSS4EGLN1MEN1KMT2AHSD17B10
SCHEMBL6619362 0.77 ALOX5 (0.60) TMPRSS4HPGDMEN1KMT2AALOX5
SCHEMBL21884385 0.76 SCN9A (0.44) TMPRSS4EGLN1HPGDKDM4EALDH1A1
SCHEMBL21884626 0.76 TMPRSS4 (0.42) TMPRSS4EGLN1MEN1KMT2AALDH1A1
SCHEMBL21884386 0.75 TMPRSS4 (0.46) TMPRSS4EGLN1MEN1KMT2AALDH1A1
SCHEMBL21884774 0.75 GSK3B (0.48) HPGDMEN1KMT2AKDM4EALDH1A1
SCHEMBL21884511 0.74 TMPRSS4 (0.44) TMPRSS4P2RX1
SCHEMBL21884388 0.74 TMPRSS4 (0.47) TMPRSS4EGLN1MEN1KMT2AP2RX1
SCHEMBL21884643 0.73 TMPRSS4 (0.51) TMPRSS4P2RX1

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-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY JNANA THERAPEUTICS INC. 2021-09-30 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-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY SLC19A1, SLC1A5, SLC1A2 TMPRSS4 1380/4885EGLN1 1665/4885HPGD 879/4885

“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.