SCHEMBL241292

SCHEMBL241292

COC(CNc1ccc(F)cc1)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
MAPK1 P28482 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.39
KCNH3 Q9ULD8 1/20 0.38
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
AOC3 Q16853 1/20 0.36
CASP3 P42574 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
SENP7 Q9BQF6 1/20 0.36

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
SCHEMBL1728733 0.80 CA1 (0.47) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL931749 0.79 MAPT (0.56) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL1565673 0.77 ALDH1A1 (0.42) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL1259735 0.77 POLB (0.49) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL4147798 0.76 MAPT (0.37) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL8575116 0.76 LOXL2 (0.40) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL6216871 0.75 MAPT (0.41) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL7005993 0.75 ADRB3 (0.43) MAPTMEN1KMT2AKDM4ERET
Ammonia Solution, Strong SCHEMBL6701042 0.75 ALDH1A1 (0.44) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL1728835 0.74 HPGD (0.47) MAPTALDH1A1MEN1KMT2AMAPK1

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-8293768-B2 Organic compounds NOVARTIS AG (CH) 2012-10-23 US disclosed
US-20120004164-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2012-01-05 US disclosed
US-8063084-B2 Heterocyclic compounds suitable for the treatment of diseases related to elevated lipid levels NOVARTIS AG (CH) 2011-11-22 US disclosed
US-20100233116-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2010-09-16 US disclosed
EP-2054408-A2 HETEROCYCLIC COMPOUNDS SUITABLE FOR THE TREATMENT OF DISEASES RELATED TO ELEVATED LIPID LEVEL Novartis Ag (CH) 2009-05-06 EP disclosed
WO-2008127349-A2 HETEROCYCLIC COMPOUNDS SUITABLE FOR THE TREATMENT OF DISEASES RELATED TO ELEVATED LIPID LEVEL NOVARTIS AG (CH) 2008-10-23 WO 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-20100233116-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 MAPT 3107/4885GAA 610/4885ALDH1A1 433/4885
US-20120004164-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 MAPT 2947/4885GAA 556/4885ALDH1A1 451/4885

“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.