SCHEMBL17463151

SCHEMBL17463151

Cc1cncc(-c2ccc3ccccc3c2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 6/20 0.51
CYP11B2 P19099 6/20 0.51
CYP1A2 P05177 6/20 0.47
CYP17A1 P05093 1/20 0.47
CYP19A1 P11511 1/20 0.47
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
CYP2C9 P11712 3/20 0.45
AR P10275 2/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 2/20 0.45
CYP2C19 P33261 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45
GFER P55789 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45

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
SCHEMBL2614938 0.79 RAB9A (0.47) CYP11B1CYP11B2CYP1A2ALDH1A1SMN1; SMN2
SCHEMBL3646698 0.79 CYP11B2 (0.53) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL12270007 0.78 CCR1 (0.56) CYP11B1CYP11B2CYP1A2ALDH1A1SMN1; SMN2
SCHEMBL16805035 0.76 CYP1A2 (0.53) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL20047742 0.76 IDO1 (0.50) CYP11B1CYP11B2KDM4ENPC1RAB9A
SCHEMBL16805039 0.75 ABL1 (0.53) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL18850044 0.75 CYP11B1 (0.50) CYP11B1CYP11B2ALDH1A1SMN1; SMN2HPGD
SCHEMBL3346194 0.74 CYP11B1 (0.50) CYP11B1CYP11B2ALDH1A1SMN1; SMN2HPGD
SCHEMBL30186359 0.74 CHEK1 (0.57) CYP11B1CYP11B2CYP1A2CYP2C9CYP2C19
SCHEMBL15888400 0.74 IDO1 (0.47) CYP11B1CYP11B2SMN1; SMN2NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9666807-B2 Organic light emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 US disclosed
US-20160028017-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-01-28 US disclosed