SCHEMBL5136270

SCHEMBL5136270

CCCCCCc1ccc(-n2c(-c3ccc(C)cc3)c(Br)c(Br)c2-c2ccc(C)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
ATM Q13315 1/20 0.46
FAAH O00519 1/20 0.46
MGLL Q99685 1/20 0.46
HSD11B1 P28845 1/20 0.43
HSD17B10 Q99714 3/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 3/20 0.42
ESR1 P03372 2/20 0.42
ADRA2A P08913 2/20 0.42
ADORA3 P0DMS8 2/20 0.42
TACR2 P21452 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
SHBG P04278 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL5012613 0.84 PTPN1 (0.42) RAB9ANPC1ATMFAAHMGLL
SCHEMBL5014187 0.83 HSD11B1 (0.39) HSD11B1TSHRALDH1A1ADORA3KDM4E
SCHEMBL5012594 0.82 PTPN1 (0.50) RAB9ANPC1ATMFAAHMGLL
SCHEMBL15281212 0.81 UCHL3 (0.59) RAB9ANPC1ATMFAAHMGLL
SCHEMBL5014227 0.80 PTPN1 (0.43) RAB9ANPC1ATMFAAHMGLL
SCHEMBL30577318 0.79 HSD17B10 (0.62) RAB9ANPC1ATMMGLLHSD11B1
SCHEMBL28385904 0.79 HSD17B10 (0.62) RAB9ANPC1ATMMGLLHSD11B1
SCHEMBL14269351 0.79 FAAH (0.57) RAB9ANPC1ATMFAAHMGLL
SCHEMBL5010872 0.78 HSD11B1 (0.43) HSD11B1TSHRALDH1A1ADORA3KDM4E
SCHEMBL4820665 0.78 RARB (0.59) RAB9ANPC1ATMHSD11B1HSD17B10

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
EP-1389626-B1 Aromatic copolymers of pyrroles and an electroluminescent element using the same KOREA INST SCI & TECH (KR) 2008-12-31 EP disclosed
US-6780950-B2 Pyrrole compounds, polymers thereof and EL element using the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2004-08-24 US disclosed
US-20040034189-A1 Pyrrole compounds, polymers thereof and EL element using the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY 2004-02-19 US disclosed
EP-1389626-A1 Aromatic copolymers of pyrroles and an electroluminescent element using the same Korea Institute of Science and Technology (KR) 2004-02-18 EP disclosed