SCHEMBL5376795

SCHEMBL5376795

Cc1ccccc1Nc1n[nH]c(SCc2ccc(Cl)s2)n1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 9/20 0.41
NPSR1 Q6W5P4 2/20 0.41
PKM P14618 1/20 0.40
LRRK2 Q5S007 1/20 0.39
POLB P06746 2/20 0.38
TP53 P04637 1/20 0.38
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HTT P42858 2/20 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
SCHEMBL5381901 0.89 METAP2 (0.42) METAP2NPSR1LRRK2TP53LMNA
SCHEMBL5372169 0.87 METAP2 (0.41) METAP2NPSR1TP53LMNASMN1; SMN2
SCHEMBL5371992 0.86 ALDH1A1 (0.45) METAP2NPSR1PKMLRRK2POLB
SCHEMBL5385605 0.86 METAP2 (0.47) METAP2POLB
SCHEMBL5378866 0.84 GAA (0.43) METAP2SMN1; SMN2NPC1RAB9AHTT
SCHEMBL5376845 0.82 METAP2 (0.48) METAP2NPSR1LMNASMN1; SMN2NPC1
SCHEMBL5380332 0.82 METAP2 (0.42) METAP2POLBTP53LMNASMN1; SMN2
SCHEMBL7089232 0.81 PKM (0.42) METAP2NPSR1PKMLRRK2POLB
SCHEMBL5387206 0.81 METAP2 (0.41) METAP2NPSR1LRRK2LMNASMN1; SMN2
SCHEMBL5372059 0.81 NFKB1 (0.44) POLBTP53LMNASMN1; SMN2NPC1

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 1/4885NPSR1 2820/4885PKM 2021/4885

“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.