SCHEMBL5374255

SCHEMBL5374255

Cc1ccc(Nc2n[nH]c(SCc3sccc3Cl)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 9/20 0.41
NPC1 O15118 5/20 0.38
RAB9A P51151 4/20 0.38
MAPT P10636 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
CASP3 P42574 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
GAA P10253 2/20 0.38
GFER P55789 1/20 0.36
LMNA P02545 1/20 0.36
APP P05067 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL5376816 0.89 SYK (0.39) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL5373679 0.88 GAA (0.42) METAP2NPC1RAB9AMAPTMEN1
SCHEMBL5371816 0.88 METAP2 (0.42) METAP2NPC1RAB9AMAPTMEN1
SCHEMBL5379210 0.88 MAPT (0.42) METAP2NPC1RAB9AMAPTMEN1
SCHEMBL5381780 0.87 NFKB1 (0.43) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL5387206 0.82 METAP2 (0.41) METAP2NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL5380332 0.81 METAP2 (0.42) METAP2NPC1RAB9AMAPTMEN1
SCHEMBL7084581 0.80 NPC1 (0.40) METAP2NPC1RAB9AMAPTMEN1
SCHEMBL5382969 0.80 SYK (0.39) METAP2NPC1RAB9AMAPTMEN1
SCHEMBL5373579 0.79 MAPT (0.44) METAP2NPC1RAB9AMAPTMEN1

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 METAP2 1/4885NPC1 4364/4885RAB9A 2324/4885

“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.