SCHEMBL3047804

SCHEMBL3047804

CC(C)C(=O)N(Cc1csc(N2CCOCC2)n1)c1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
LMNA P02545 5/20 0.45
HTT P42858 2/20 0.45
MAPT P10636 4/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 2/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
APEX1 P27695 1/20 0.42
MPI P34949 1/20 0.42
RECQL P46063 1/20 0.42
MCL1 Q07820 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GRIA2 P42262 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL3064271 0.89 AR (0.50) ARNPC1RAB9ALMNAHTT
SCHEMBL3059056 0.86 AR (0.47) ARNPC1RAB9ALMNAHTT
SCHEMBL3071134 0.84 AR (0.47) ARNPC1RAB9ALMNAHTT
SCHEMBL3829564 0.83 ALDH1A1 (0.46) ARNPC1RAB9ALMNAHTT
SCHEMBL3063947 0.83 AR (0.45) ARNPC1RAB9ALMNAHTT
SCHEMBL3821644 0.83 LMNA (0.49) ARNPC1RAB9ALMNAHTT
SCHEMBL3058257 0.82 SMN1; SMN2 (0.46) ARNPC1RAB9ALMNAHTT
SCHEMBL3826390 0.82 MAPT (0.50) ARNPC1RAB9ALMNAHTT
SCHEMBL4738762 0.81 AR (0.44) ARNPC1RAB9ALMNAHTT
SCHEMBL4739647 0.80 AR (0.43) ARNPC1RAB9ALMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 US claimed
EP-2099754-A1 ION CHANNEL MODULATORS Wyeth a Corporation of the State of Delaware (US) 2009-09-16 EP claimed
WO-2008073929-A1 ION CHANNEL MODULATORS WYETH (US) 2008-06-19 WO claimed
US-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 US disclosed
US-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 US disclosed
US-20100267697-A1 ION CHANNEL MODULATORS WYETH (US) 2010-10-21 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-20100267697-A1 ION CHANNEL MODULATORS CACNA1E, CACNA1A, CACNA1S AR 289/4885NPC1 481/4885RAB9A 997/4885

“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.