SCHEMBL17849664

SCHEMBL17849664

CC1(C)c2cc(-c3ccccc3)cc3ccc4cc(-c5ccc(N(c6ccc(-c7cccnc7)cc6)c6ccc7ccccc7c6)cc5)cc1c4c23

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 8/20 0.51
CYP11B1 P15538 8/20 0.51
CYP19A1 P11511 7/20 0.51
CYP17A1 P05093 4/20 0.51
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
CYP2A6 P11509 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
LPL P06858 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
DHODH Q02127 1/20 0.35
GBA1 P04062 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL17849665 0.93 CYP11B2 (0.46) CYP11B2CYP11B1CYP19A1CYP17A1CYP2A6
SCHEMBL17849678 0.93 CYP11B2 (0.46) CYP11B2CYP11B1CYP19A1CYP17A1CYP2A6
SCHEMBL17849669 0.92 CYP11B2 (0.43) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL15909623 0.90 CYP11B2 (0.44) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL15909655 0.89 CYP19A1 (0.43) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL15909624 0.86 CYP11B2 (0.40) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL17849666 0.86 CYP11B2 (0.51) CYP11B2CYP11B1CYP19A1CYP17A1GBA1
SCHEMBL15909650 0.86 CYP11B2 (0.41) CYP11B2CYP11B1CYP19A1CYP17A1CYP2A6
SCHEMBL15423166 0.86 CYP19A1 (0.55) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL15909664 0.85 CYP11B2 (0.50) CYP11B2CYP11B1CYP19A1CYP17A1GBA1

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
US-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed
US-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed