SCHEMBL5795385

SCHEMBL5795385

OCc1ccc2c(c1)c1ccccc1n2Cc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.68
P2RX4 Q99571 2/20 0.56
SRC P12931 1/20 0.54
KDM4E B2RXH2 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 2/20 0.51
ALDH1A1 P00352 1/20 0.51
HDAC6 Q9UBN7 2/20 0.50
PGR P06401 2/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC10 Q969S8 1/20 0.50
MAPK1 P28482 3/20 0.48
TP53 P04637 2/20 0.47
MCL1 Q07820 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL24088568 0.85 CYP19A1 (0.47) CYP19A1P2RX4SRCKDM4EMEN1
SCHEMBL3022170 0.85 CYP19A1 (0.60) CYP19A1P2RX4SRCKDM4EMEN1
SCHEMBL30007452 0.82 CYP19A1 (1.00) CYP19A1P2RX4SRCKDM4EMEN1
SCHEMBL151053 0.82 CYP19A1 (1.00) CYP19A1P2RX4SRCKDM4EMEN1
SCHEMBL4849333 0.82 KDM4E (0.67) KDM4EMEN1KMT2ASMN1; SMN2MAPT
Bromide SCHEMBL28888744 0.80 CYP19A1 (0.95) CYP19A1P2RX4SRCKDM4EMEN1
Ammonia Solution, Strong SCHEMBL29210102 0.80 CYP19A1 (0.95) CYP19A1P2RX4SRCKDM4EMEN1
SCHEMBL9398256 0.80 CYP19A1 (0.95) CYP19A1P2RX4SRCKDM4EMEN1
SCHEMBL13957035 0.80 CYP19A1 (0.86) CYP19A1P2RX4HDAC6HDAC1HDAC10
SCHEMBL17251490 0.80 CYP19A1 (0.62) CYP19A1P2RX4SRCKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090066238-A1 Electroluminescent materials grafted with charge transport moieties having graded ionization potential or electrophilic property and their application in light-emitting diodes NATIONAL TSING HUA UNIVERSITY (TW) 2009-03-12 US disclosed
US-20090066238-A1 Electroluminescent materials grafted with charge transport moieties having graded ionization potential or electrophilic property and their application in light-emitting diodes NATIONAL TSING HUA UNIVERSITY (TW) 2009-03-12 US disclosed
WO-2006012310-A2 CARBAZOLE DERIVATIVES FOR TREATING POLYCYSTIC KIDNEY DISEASE GENZYME CORPORATION (US) 2006-02-02 WO disclosed