SCHEMBL18930958

SCHEMBL18930958

CC(C)c1ccc2[nH]c(S)nc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 1/20 0.41
▸ MLKL Q8NB16 1/20 0.40
▸ KIF11 P52732 1/20 0.39
▸ EIF4A3 P38919 3/20 0.38
▸ KDM4E B2RXH2 4/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ SCN4A P35499 1/20 0.37
▸ MAPT P10636 3/20 0.36
▸ TP53 P04637 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ GAA P10253 1/20 0.34
▸ THRB P10828 1/20 0.33
▸ HTR1D P28221 1/20 0.33
▸ HDAC3 O15379 1/20 0.33

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
SCHEMBL29770380 0.86 SCN10A (0.55) SCN10AMLKLKIF11EIF4A3KDM4E
SCHEMBL17821440 0.86 SCN10A (0.55) SCN10AMLKLKIF11EIF4A3KDM4E
SCHEMBL6888843 0.80 ALDH1A1 (0.44) SCN10AMLKLKIF11EIF4A3KDM4E
SCHEMBL889358 0.80 HSD17B10 (0.59) SCN10AMLKLKIF11EIF4A3KDM4E
SCHEMBL9940567 0.79 MLKL (0.43) SCN10AMLKLKIF11EIF4A3KDM4E
SCHEMBL5683519 0.79 FABP6 (0.50) SCN10AMLKLKIF11EIF4A3KDM4E
SCHEMBL5765414 0.77 PYGL (0.37) SCN10AMLKLKDM4ELMNASMN1; SMN2
SCHEMBL5988285 0.76 SMN1; SMN2 (0.43) SCN10AMLKLKIF11EIF4A3KDM4E
SCHEMBL10299138 0.76 DDAH1 (0.54) SCN10AMLKLKIF11EIF4A3KDM4E
SCHEMBL229607 0.76 KMT2A (0.44) HSD17B10NPC1RAB9AMAPTMEN1

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-10028937-B2 Anti-viral compounds ABBVIE INC. (US) 2018-07-24 — — US disclosed
US-20170157105-A1 Anti-Viral Compounds ABBVIE INC. (US) 2017-06-08 — — 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 (2 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-10028937-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS SCN10A 4583/4885MLKL 3374/4885KIF11 3591/4885
US-20170157105-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS SCN10A 4583/4885MLKL 3374/4885KIF11 3591/4885

“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.

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