SCHEMBL1821486

SCHEMBL1821486

O=CCc1cc(F)ccn1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
FERMT2 Q96AC1 1/20 0.32
KMO O15229 1/20 0.32
GRM5 P41594 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C9 P11712 2/20 0.31
RAB9A P51151 1/20 0.31
LOXL2 Q9Y4K0 1/20 0.31

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
SCHEMBL7664828 0.77
SCHEMBL14855446 0.76 KDM4E (0.41) KDM4ECYP2C9
SCHEMBL3363951 0.76 ALDH1A1 (0.38) KDM4EFERMT2
SCHEMBL4030600 0.76 UHRF1 (0.45) KDM4EKMT2A
SCHEMBL29796563 0.76 NOS3 (0.47)
SCHEMBL16175631 0.74 NOS3 (0.50) KDM4EKMT2ARAB9A
SCHEMBL23530510 0.72
SCHEMBL2307410 0.72
SCHEMBL12193022 0.72
SCHEMBL8237147 0.72

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
EP-2315751-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS Amgen Inc. (US) 2011-05-04 EP disclosed
WO-2009158011-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS AMGEN INC. (US) 2009-12-30 WO disclosed