SCHEMBL21884580

SCHEMBL21884580

CNC(=O)c1ccc(O)c(C(=O)NC(=N)N)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 7/20 0.53
F10 P00742 6/20 0.47
PLAT P00750 6/20 0.47
F2 P00734 5/20 0.47
CA2 P00918 1/20 0.41
HDAC6 Q9UBN7 3/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC2 Q92769 1/20 0.40
THRB P10828 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
PLG P00747 2/20 0.38
EGFR P00533 1/20 0.38
ALOX5 P09917 1/20 0.38
PYGL P06737 1/20 0.38
NEU3 Q9UQ49 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL8446220 0.86 PLAU (0.48) PLAUF10PLATF2HDAC6
SCHEMBL8445926 0.86 PLAU (0.48) PLAUF10PLATF2PLG
Hydrochloric Acid SCHEMBL8445397 0.85 F10 (0.47) PLAUF10PLATF2PLG
SCHEMBL21884653 0.76 PLAU (0.61) PLAUF10PLATF2NPC1
SCHEMBL21884644 0.76 PPIA (0.50) PLAUF10PLATF2CA2
SCHEMBL23875335 0.76 P2RX1 (0.57) CA2KMT2A
SCHEMBL8768105 0.76 HSP90AA1 (0.49) PLAUF10F2HTT
SCHEMBL8599773 0.76 HDAC6 (0.46) PLAUCA2HDAC6HDAC8HDAC2
SCHEMBL21884475 0.75 LMNA (0.42) PLAUF10PLATF2ALOX5
Hydrochloric Acid SCHEMBL8506619 0.75 HSP90AA1 (0.48) PLAUF10F2HTT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS INC. 2021-12-02 US disclosed
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS INC. 2021-12-02 US disclosed
US-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY JNANA THERAPEUTICS INC. 2021-09-30 US disclosed
US-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY JNANA THERAPEUTICS INC. 2021-09-30 US disclosed
WO-2020061473-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS JNANA THERAPEUTICS, INC. (US) 2020-03-26 WO 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-20210299070-A1 METHODS OF TREATING CREATINE TRANSPORTER DEFICIENCY SLC19A1, SLC1A5, SLC1A2 PLAU 986/4885F10 4684/4885PLAT 1711/4885
US-20210371403-A1 SMALL MOLECULES TARGETING MUTANT MAMMALIAN PROTEINS SNRPE, G3BP1, G3BP2 PLAU 3975/4885F10 4139/4885PLAT 4256/4885

“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.