SCHEMBL6408096

SCHEMBL6408096

Oc1ccc(-c2nnc(S)n2-c2cccc(Cl)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 3/20 0.43
MDM2 Q00987 2/20 0.43
OPRD1 P41143 4/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
NOTUM Q6P988 1/20 0.42
TSHR P16473 1/20 0.40
OPRM1 P35372 1/20 0.40
TP53 P04637 2/20 0.39
PKM P14618 1/20 0.39
TACR1 P25103 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL930093 0.84 ESR1 (0.48) PRKCZMDM2ALDH1A1MEN1LMNA
SCHEMBL10480393 0.83 OPRD1 (0.51) MDM2OPRD1ALDH1A1NOTUMTSHR
SCHEMBL5332712 0.82 AVPR1A (0.51) MDM2OPRD1ALDH1A1MEN1KMT2A
SCHEMBL1104410 0.78 MDM2 (0.46) MDM2ALDH1A1MEN1LMNAMAPT
SCHEMBL14293441 0.78 GUSB (0.43) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL1104429 0.76 GLA (0.56) ALDH1A1MEN1LMNAMAPTKMT2A
SCHEMBL14345465 0.75 ALDH1A1 (0.48) MDM2ALDH1A1MEN1MAPTKMT2A
SCHEMBL11511067 0.73 AVPR1A (0.59) OPRD1ALDH1A1MEN1KMT2ATSHR
SCHEMBL29713827 0.72 OPRD1 (0.53) OPRD1ALDH1A1MEN1KMT2ATSHR
SCHEMBL10012472 0.72 MEN1 (0.41) ALDH1A1MEN1MAPTKMT2ATSHR

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 PRKCZ 2400/4885MDM2 1609/4885OPRD1 4268/4885

“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.