SCHEMBL16752103

SCHEMBL16752103

Cc1cc(N)ccc1Oc1cccc(N)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
PIK3CA P42336 1/20 0.43
KEAP1 Q14145 1/20 0.43
ALDH1A1 P00352 8/20 0.41
GAA P10253 2/20 0.40
CASP1 P29466 2/20 0.39
PDE10A Q9Y233 1/20 0.37
KDM4E B2RXH2 4/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
LMNA P02545 2/20 0.37
KMT2A Q03164 2/20 0.37
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
NUDT1 P36639 1/20 0.35
CD44 P16070 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
ADRA2B P18089 1/20 0.34
PTGS1 P23219 1/20 0.34

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
SCHEMBL10363801 0.88 CYP3A4 (0.45) CYP3A4TSHRPIK3CAKEAP1ALDH1A1
Hydrochloric Acid SCHEMBL10363807 0.86 ALDH1A1 (0.45) CYP3A4TSHRPIK3CAKEAP1ALDH1A1
SCHEMBL29549546 0.83 ALDH1A1 (0.48) CYP3A4TSHRALDH1A1CASP1PDE10A
SCHEMBL8174091 0.83 CYP3A4 (0.62) CYP3A4TSHRPIK3CAKEAP1ALDH1A1
SCHEMBL30473086 0.83 ALDH1A1 (0.56) CYP3A4TSHRALDH1A1GAACASP1
SCHEMBL4329985 0.83 ALDH1A1 (0.56) CYP3A4TSHRALDH1A1GAACASP1
SCHEMBL5552568 0.82 SMN1; SMN2 (0.47) TSHRKEAP1ALDH1A1CASP1PDE10A
SCHEMBL13394018 0.81 CYP3A4 (0.59) CYP3A4TSHRPIK3CAKEAP1ALDH1A1
SCHEMBL27746114 0.80 ALDH1A1 (0.44) CYP3A4TSHRPIK3CAKEAP1ALDH1A1
SCHEMBL6289998 0.79 CYP3A4 (0.56) CYP3A4TSHRPIK3CAKEAP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11111345-B2 Prepreg and carbon fiber-reinforced composite material TORAY INDUSTRIES, INC. (JP) 2021-09-07 US disclosed
US-20170327657-A1 PREPREG AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES, INC. (JP) 2017-11-16 US disclosed
US-9765194-B2 Prepreg and carbon fiber-reinforced composite material TORAY INDUSTRIES, INC. (JP) 2017-09-19 US disclosed
EP-2878617-B1 PREPREG AND CARBON-FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES (JP) 2017-03-01 EP disclosed
US-20150210813-A1 PREPREG AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES, INC. (JP) 2015-07-30 US disclosed
EP-2878617-A1 PREPREG AND CARBON-FIBER-REINFORCED COMPOSITE MATERIAL Toray Industries, Inc. (JP) 2015-06-03 EP disclosed