SCHEMBL880493

SCHEMBL880493

CCc1ccc(C2CC(=O)Nc3c2ccc2ccccc32)s1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.57
▸ LMNA P02545 3/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ MAPT P10636 3/20 0.49
▸ HTT P42858 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ KMT2A Q03164 1/20 0.47
▸ IDO1 P14902 2/20 0.45
▸ TP53 P04637 5/20 0.41
▸ POLB P06746 2/20 0.37
▸ PDE5A O76074 5/20 0.37
▸ PDE11A Q9HCR9 2/20 0.37
▸ PDE6C P51160 1/20 0.37

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
SCHEMBL880369 0.85 LMNA (0.59) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL880243 0.82 LMNA (0.59) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL880257 0.82 LMNA (0.59) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL880272 0.78 LMNA (0.62) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL880385 0.77 LMNA (0.65) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL880307 0.76 IDO1 (0.70) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL852442 0.75 LMNA (0.72) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL880251 0.74 LMNA (0.61) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL14047395 0.74 HSD17B10 (0.62) HSD17B10LMNASMN1; SMN2MAPTHTT
SCHEMBL10280624 0.74 LMNA (0.60) HSD17B10LMNASMN1; SMN2MAPTHTT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130289022-A1 TETRAMERIC ALPHA-SYNUCLEIN AND USE THEREOF BRANDEIS UNIVERSITY (US) 2013-10-31 — — US disclosed
US-8440705-B2 2,3,4,7,8,9-hexahydro-1H-cyclopenta[h]quinolin-2-one or 2,3,4,6,7,8-hexahydro-1H-cyclopenta[g]quinolin-2-one; Alzheimer's disease WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2013-05-14 — — US disclosed
EP-2433634-A2 Compounds, compositions and methods of inhibiting a-synuclein toxicity The Whitehead Institute for Biomedical Research (US) 2012-03-28 — — EP disclosed
US-20100004277-A1 COMPOUNDS AND METHODS FOR MODULATING PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-01-07 — — US disclosed
US-20100004277-A1 COMPOUNDS AND METHODS FOR MODULATING PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-01-07 — — 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-20100004277-A1 COMPOUNDS AND METHODS FOR MODULATING PROTEIN TRAFFICKING GOLT1B, NPC1L1, NPC1 HSD17B10 3617/4885LMNA 3569/4885SMN1; SMN2 229/4885

“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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