SCHEMBL25666306

SCHEMBL25666306

N#Cc1nc2ccc(NC(=O)CN)cc2s1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.64
CA2 P00918 5/20 0.64
LDHA P00338 4/20 0.49
MAPT P10636 4/20 0.47
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 1/20 0.46
DYRK1A Q13627 1/20 0.45
HTT P42858 1/20 0.45
POLB P06746 1/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL1079950 0.86 LDHA (0.49) CA1CA2LDHAMAPTRAB9A
SCHEMBL15797999 0.85 LDHA (0.70) CA1CA2LDHAMAPTRAB9A
SCHEMBL24512595 0.84 LDHA (0.58) CA1CA2LDHAMAPTRAB9A
SCHEMBL22009959 0.84 LDHA (0.55) CA1CA2LDHAMAPTRAB9A
SCHEMBL16209768 0.83 LDHA (0.54) LDHAMAPTRAB9ANPC1SMN1; SMN2
Hydrochloric Acid SCHEMBL6093737 0.81 CA1 (0.67) CA1CA2LDHAMAPTRAB9A
SCHEMBL24512590 0.81 LDHA (0.55) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL12312847 0.80 RAB9A (0.50) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL1741698 0.79 TP53 (0.54) CA1CA2LDHAMAPTRAB9A
SCHEMBL20486301 0.79 CA1 (0.41) CA1CA2LDHAMAPTRAB9A

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-20230165780-A1 CROSSLINKED MATERIALS FOUNT BIO, INC. 2023-06-01 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-20230165780-A1 CROSSLINKED MATERIALS DCLRE1A, COL2A1, MTCL3 CA1 1810/4885CA2 2913/4885LDHA 485/4885

“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.