SCHEMBL6825671

SCHEMBL6825671

CCC(C)c1ccccc1Nc1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.42
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.37
PKM P14618 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
SLC2A1 P11166 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NAT1 P18440 1/20 0.35
FPR2 P25090 2/20 0.35
CCNE2 O96020 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
SCHEMBL11810264 0.86 TSHR (0.50) TSHRHTTKDM4EPKMMEN1
SCHEMBL5786752 0.80 PIK3CA (0.42) TSHRHTTPIK3CAPIK3CBPIK3CG
SCHEMBL8418919 0.75 TSHR (0.39) TSHRHTTKDM4EPKMMEN1
SCHEMBL16694156 0.74 TSHR (0.47) TSHRRAB9APKMMEN1KMT2A
SCHEMBL11129227 0.73 MAPT (0.41) TSHRHTTRAB9AKDM4EMEN1
SCHEMBL23341753 0.73 TSHR (0.55) TSHRHTTRAB9AKDM4EPKM
SCHEMBL4089395 0.73 TSHR (0.55) TSHRHTTRAB9AKDM4EPKM
SCHEMBL22624549 0.73 TSHR (0.55) TSHRHTTRAB9AKDM4EPKM
SCHEMBL8418920 0.73 HTT (0.35) TSHRHTTRAB9AKDM4EPKM
SCHEMBL31310663 0.73 POLB (0.47) HTTRAB9AKDM4EMEN1KMT2A

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
EP-1385919-A1 SUBSTITUTED FLUORENE POLYMERS, THEIR PREPARATION AND USES Cambridge Display Technology Limited (GB) 2004-02-04 EP disclosed
WO-2002092724-A1 SUBSTITUTED FLUORENE POLYMERS, THEIR PREPARATION AND USES CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2002-11-21 WO disclosed