SCHEMBL17484559

SCHEMBL17484559

Cc1ccc2c(c1)Sc1cc(C)ccc1N2CCC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.62
KMT2A Q03164 5/20 0.62
LMNA P02545 1/20 0.62
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.46
POLB P06746 2/20 0.46
HSD17B10 Q99714 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KMO O15229 1/20 0.43
PKM P14618 1/20 0.42
FNTA P49354 4/20 0.42
FNTB P49356 4/20 0.42
HTT P42858 1/20 0.41
DRD3 P35462 1/20 0.41
TP53 P04637 1/20 0.41
MAPK1 P28482 1/20 0.41
KCNK2 O95069 1/20 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
SCHEMBL17482013 0.92 MEN1 (0.54) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL17356858 0.84 MAPT (0.51) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL17356861 0.82 MAPT (0.49) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL17356845 0.82 MAPT (0.74) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL7125015 0.81 MEN1 (0.62) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL16156849 0.81 MEN1 (0.62) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL15237167 0.78 DRD3 (0.45) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL179882 0.77 MEN1 (1.00) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL31014072 0.77 MEN1 (1.00) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL13212466 0.76 DRD3 (0.49) MEN1KMT2ALMNAMAPTALDH1A1

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-20160031814-A1 MODULATION OF K2P CHANNELS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-02-04 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-20160031814-A1 MODULATION OF K2P CHANNELS KCNJ2, KCNK2, KCNN3 MEN1 4246/4885KMT2A 449/4885LMNA 2035/4885

“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.