SCHEMBL15730873

SCHEMBL15730873

CCN(CC)S(=O)(=O)c1ccc(-c2ccnnc2C)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.60
▸ HTT P42858 3/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ TP53 P04637 1/20 0.55
▸ ALDH1A1 P00352 6/20 0.50
▸ GAA P10253 3/20 0.48
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ MAPT P10636 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL15723919 0.83 LMNA (0.54) LMNAHTTSMN1; SMN2TP53ALDH1A1
SCHEMBL15730736 0.81 HTT (0.62) LMNAHTTSMN1; SMN2TP53ALDH1A1
SCHEMBL5023540 0.71 HTT (0.73) LMNAHTTSMN1; SMN2ALDH1A1NPC1
SCHEMBL15724378 0.70 LMNA (0.55) LMNAHTTSMN1; SMN2TP53ALDH1A1
SCHEMBL23043651 0.70 LMNA (0.70) LMNAHTTSMN1; SMN2TP53ALDH1A1
SCHEMBL31649184 0.69 LMNA (0.62) LMNAHTTSMN1; SMN2ALDH1A1NPC1
SCHEMBL23057256 0.68 LMNA (0.73) LMNAHTTSMN1; SMN2TP53ALDH1A1
SCHEMBL10592845 0.68 LMNA (0.73) LMNAHTTSMN1; SMN2TP53ALDH1A1
SCHEMBL17073215 0.67 ALDH1A1 (1.00) LMNAHTTSMN1; SMN2TP53ALDH1A1
SCHEMBL3314209 0.67 LMNA (0.70) LMNAHTTSMN1; SMN2ALDH1A1GAA

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-9540343-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2017-01-10 — — US disclosed
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2014-05-22 — — 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-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN LMNA 3182/4885HTT 4049/4885SMN1; SMN2 3500/4885

“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.

Send feedback