SCHEMBL20125021

SCHEMBL20125021

CC1=CN2CCN=C2C(Cl)=C1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.34

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
SCHEMBL11540971 0.81 KDM4E (0.53) KDM4EALDH1A1GLAGAA
SCHEMBL3851283 0.78 KDM4E (0.39) KDM4EALDH1A1GLAGAA
SCHEMBL2606658 0.62 KDM4E (0.51) KDM4EALDH1A1
SCHEMBL14309129 0.58 HDAC8 (0.30)
SCHEMBL20049146 0.58 KDM4E (0.51) KDM4EALDH1A1GAA
SCHEMBL14309130 0.57 HRH4 (0.33)
SCHEMBL8446377 0.57 HDAC8 (0.33)
SCHEMBL13944479 0.55
SCHEMBL11299918 0.54
SCHEMBL11539073 0.54 KDM4E (0.30) KDM4EALDH1A1GAA

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
EP-3318557-A2 QUINOLONE COMPOUND Otsuka Pharmaceutical Co., Ltd. (JP) 2018-05-09 EP disclosed