SCHEMBL2392625

SCHEMBL2392625

CC(C)(C)c1ccc(Nc2ccc(Nc3ccc(C(C)(C)C)cc3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
LMNA P02545 1/20 0.50
TYR P14679 1/20 0.50
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPK1 P28482 2/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
XBP1 P17861 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
KIF11 P52732 1/20 0.47
HDAC3 O15379 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
EPHX2 P34913 1/20 0.45
NR1H4 Q96RI1 1/20 0.45
DHODH Q02127 2/20 0.44

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
SCHEMBL49741 1.00 TSHR (0.52) TSHRLMNATYRNPC1RAB9A
SCHEMBL22432523 0.92 TSHR (0.46) TSHRLMNATYRNPC1RAB9A
SCHEMBL2957181 0.92 KIF11 (0.57) TSHRLMNATYRNPC1RAB9A
SCHEMBL5396983 0.92 TSHR (0.46) TSHRLMNATYRNPC1RAB9A
SCHEMBL13321302 0.92 KIF11 (0.57) TSHRLMNATYRNPC1RAB9A
SCHEMBL12278117 0.90 TSHR (0.71) TSHRLMNATYRNPC1RAB9A
SCHEMBL502030 0.90 ALDH1A1 (0.62) TSHRLMNARAB9ASMN1; SMN2MAPK1
SCHEMBL24137667 0.88 TSHR (0.42) TSHRLMNATYRNPC1RAB9A
SCHEMBL20683954 0.88 TSHR (0.42) TSHRLMNATYRNPC1RAB9A
SCHEMBL5539876 0.88 DHODH (0.42) TSHRLMNATYRNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10745613-B2 Near-IR absorptive compounds and devices incorporating the same GENTEX CORPORATION (US) 2020-08-18 US disclosed
WO-2018075533-A1 NEAR-IR ABSORPTIVE COMPOUNDS AND DEVICES INCORPORATING THE SAME GENTEX CORPORATION (US) 2018-04-26 WO disclosed
US-20180105738-A1 NEAR-IR ABSORPTIVE COMPOUNDS AND DEVICES INCORPORATING THE SAME GENTEX CORP (US) 2018-04-19 US disclosed
US-20180105738-A1 NEAR-IR ABSORPTIVE COMPOUNDS AND DEVICES INCORPORATING THE SAME GENTEX CORP (US) 2018-04-19 US disclosed
EP-1935919-B1 POLYMER CONTAINING SULFO GROUP AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THE POLYMER YAMAMOTO CHEMICALS INC (JP) 2012-09-05 EP disclosed
US-8012608-B2 Polymer containing sulfo group and organic electroluminescent element containing the polymer Yamamoto Chemcials, Inc. (JP) 2011-09-06 US disclosed
US-20090230851-A1 Polymer Containing Sulfo Group and Organic Electroluminescent Element Containing the Polymer MITSUI CHEMICALS, INC. (JP) 2009-09-17 US disclosed
EP-1935919-A1 POLYMER CONTAINING SULFO GROUP AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THE POLYMER Mitsui Chemicals, Inc. (JP) 2008-06-25 EP disclosed