SCHEMBL16219720

SCHEMBL16219720

CC1(C)c2cc(Cl)ccc2-c2c1cc(Br)c1ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.40
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
PTGES O14684 1/20 0.34
ACHE P22303 1/20 0.32
PGR P06401 2/20 0.32
AKR1A1 P14550 1/20 0.31
AKR1B1 P15121 1/20 0.31
DPP4 P27487 1/20 0.31
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30
S100A4 P26447 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL14063305 0.85 PDK2 (0.36) PDK2CA1CA2CA4CA6
SCHEMBL29963982 0.85 PDK2 (0.36) PDK2CA1CA2CA4CA6
SCHEMBL13789948 0.84 CYP2D6 (0.31) MAPTSMN1; SMN2CYP2D6CYP2C19
SCHEMBL26569241 0.84 CRHR1 (0.37) PDK2CA1CA2CA4CA6
SCHEMBL20208838 0.83 ALK (0.30) MAPTSMN1; SMN2CYP2D6CYP2C19
SCHEMBL10010551 0.83 PDK2 (0.38) PDK2PGRMAPTSMN1; SMN2CYP2D6
SCHEMBL29518351 0.83 PDK2 (0.38) PDK2PGRMAPTSMN1; SMN2CYP2D6
SCHEMBL15895329 0.83 CYP2D6 (0.30) MAPTSMN1; SMN2CYP2D6CYP2C19
SCHEMBL21217710 0.82 MEN1 (0.39) PDK2CA1CA2CA4CA6
SCHEMBL20515303 0.82 CYP2D6 (0.30) CYP2D6CYP2C19

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-9082987-B2 Benzofluorene-based compounds and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-07-14 US disclosed
US-9082987-B2 Benzofluorene-based compounds and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-07-14 US disclosed
US-20140326961-A1 BENZOFLUORENE-BASED COMPOUNDS AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-06 US disclosed
US-20140326961-A1 BENZOFLUORENE-BASED COMPOUNDS AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-06 US disclosed