SCHEMBL19697643

SCHEMBL19697643

CCOC(=O)c1cnc2cc(C(C)C)ccn12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.51
GLA P06280 3/20 0.51
GAA P10253 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 2/20 0.43
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
CYP11B1 P15538 2/20 0.43
CYP11B2 P19099 2/20 0.43
CYP2C19 P33261 2/20 0.43
LMNA P02545 1/20 0.43
CYP2C9 P11712 1/20 0.43
ABCB11 O95342 1/20 0.43
GABRA2 P47869 1/20 0.43
TGFBR1 P36897 2/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
PIK3CD O00329 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
SCHEMBL17437968 0.91 KDM4E (0.50) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL19697618 0.87 CYP1A2 (0.49) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL30935757 0.85 KDM4E (0.45) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL19697598 0.84 CYP1A2 (0.46) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL14742881 0.84 KDM4E (0.70) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL9941870 0.83 KDM4E (0.54) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL2051512 0.82 GAA (0.53) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL16370033 0.82 KDM4E (0.53) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL17438045 0.82 KDM4E (0.53) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL2046586 0.82 KDM4E (0.53) KDM4EGLAGAAALDH1A1HPGD

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
WO-2017214413-A1 IMIDAZO[1,2-A]PYRIDINE DERIVATIVES AS HISTONE DEMETHYLASE INHIBITORS Chrysalis, Inc. (US) 2017-12-14 WO disclosed