SCHEMBL6403770

SCHEMBL6403770

c1csc(-c2nnc(SCc3ccncc3)[nH]2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.44
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
TSHR P16473 5/20 0.44
HPGD P15428 4/20 0.44
KDM4E B2RXH2 4/20 0.44
LMNA P02545 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
HSD17B10 Q99714 2/20 0.44
MAPK10 P53779 1/20 0.44
CYP17A1 P05093 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
RAB9A P51151 9/20 0.43
NPC1 O15118 8/20 0.43
TP53 P04637 1/20 0.43
RXFP1 Q9HBX9 2/20 0.40
POLB P06746 2/20 0.40

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
SCHEMBL6409758 0.86 SMN1; SMN2 (0.56) SMN1; SMN2MEN1KMT2ATSHRHPGD
SCHEMBL6404560 0.82 HPGD (0.51) SMN1; SMN2MEN1KMT2ATSHRHPGD
SCHEMBL6406549 0.79 MAPT (0.51) SMN1; SMN2MEN1KMT2ATSHRHPGD
SCHEMBL6429452 0.78 CTSB (0.47) MEN1KMT2AHPGDKDM4ENPSR1
SCHEMBL6404584 0.78 RAB9A (0.48) SMN1; SMN2MEN1KMT2ATSHRHPGD
SCHEMBL6403484 0.77 ADORA3 (0.41) SMN1; SMN2MEN1KMT2AHPGDKDM4E
SCHEMBL6410721 0.76 BCAT1 (0.40) SMN1; SMN2MEN1KMT2ATSHRHPGD
SCHEMBL6406156 0.75 GRK6 (0.59) SMN1; SMN2MEN1KMT2AHPGDKDM4E
SCHEMBL6405499 0.75 ALDH1A1 (0.46) SMN1; SMN2MEN1KMT2ATSHRHPGD
SCHEMBL16171148 0.74 MEN1 (0.54) SMN1; SMN2MEN1KMT2ATSHRHPGD

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-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof AGRIUS GROUP, LLC. 2005-12-29 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-20050288347-A1 Certain triazole-based compounds, compositions, and uses thereof ABCG2, ATP5ME, DNTT SMN1; SMN2 4793/4885MEN1 3562/4885KMT2A 2263/4885

“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.