SCHEMBL5384683

SCHEMBL5384683

Fc1ccc(Nc2n[nH]c(SCc3ccsc3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 8/20 0.40
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
SYK P43405 1/20 0.35
ADORA2A P29274 1/20 0.35
CTSC P53634 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
AURKA O14965 1/20 0.35
GAA P10253 1/20 0.35
GFER P55789 1/20 0.35
TP53 P04637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL5384643 0.88 METAP2 (0.43) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL5396780 0.88 GAA (0.47) KCNH3MEN1KMT2ANPC1RAB9A
SCHEMBL7083578 0.80 NPC1 (0.38) KCNH3MEN1KMT2ANPC1RAB9A
SCHEMBL5385474 0.80 NFKB1 (0.40) KCNH3MEN1KMT2ANPC1RAB9A
SCHEMBL5397103 0.79 KCNH3 (0.40) KCNH3MEN1KMT2ANPC1RAB9A
SCHEMBL5371785 0.77 METAP2 (0.46) NPC1RAB9ALMNAMAPTSMN1; SMN2
SCHEMBL5376816 0.77 SYK (0.39) KCNH3MEN1KMT2ANPC1RAB9A
SCHEMBL5382969 0.77 SYK (0.39) KCNH3MEN1KMT2ANPC1RAB9A
SCHEMBL5372028 0.77 POLA1 (0.45) KCNH3MEN1KMT2ANPC1RAB9A
SCHEMBL5371868 0.77 EGFR (0.41) MEN1KMT2ANPC1RAB9AMAPT

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-7304082-B2 1,2,4-triazole derivatives, compositions, process of making and methods of use SMITHKLINE BEECHAM CORPORATION (US) 2007-12-04 US disclosed
US-20050267185-A1 1,2,4-triazole derivatives, compositions, process of making and methods of use SMITHKLINE BEECHAM CORPORATION 2005-12-01 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-20050267185-A1 1,2,4-triazole derivatives, compositions, process of making and methods of use METAP2, METAP1, DNPEP KCNH3 4520/4885MEN1 1981/4885KMT2A 1092/4885

“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.