SCHEMBL16692011

SCHEMBL16692011

C#Cc1ccc(OCC)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM1A O60341 2/20 0.35
ALDH1A1 P00352 4/20 0.34
FGFR2 P21802 2/20 0.34
KDM4E B2RXH2 3/20 0.33
MAPT P10636 3/20 0.33
AR P10275 2/20 0.33
GAA P10253 1/20 0.33
NQO1 P15559 1/20 0.33
TUBB1 Q9H4B7 1/20 0.33
HSD17B10 Q99714 3/20 0.32
MAPK1 P28482 3/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL15087089 0.84 ALDH1A1 (0.43) L3MBTL1CYP1A2CYP2C19ALDH1A1MAPT
SCHEMBL9710347 0.83 ALDH1A1 (0.45) L3MBTL1ALDH1A1MAPTMEN1HPGD
SCHEMBL9706445 0.83 ALDH1A1 (0.45) L3MBTL1ALDH1A1MAPTMEN1HPGD
SCHEMBL9706357 0.83 ALDH1A1 (0.45) L3MBTL1ALDH1A1MAPTMEN1HPGD
SCHEMBL17527769 0.81 L3MBTL1 (0.48) L3MBTL1CYP1A2CYP2D6CYP2C19TDP1
SCHEMBL9405959 0.81 AR (0.45) L3MBTL1ALDH1A1KDM4EMAPTAR
SCHEMBL27719361 0.80 ALDH1A1 (0.36) ALDH1A1KDM4EARTUBB1MAPK1
SCHEMBL16692012 0.75 FGFR2 (0.36) L3MBTL1CYP1A2CYP2D6CYP2C19TDP1
SCHEMBL21165796 0.74 L3MBTL1 (0.41) L3MBTL1CYP1A2CYP2D6CYP2C19TDP1
SCHEMBL9710261 0.73 ALDH1A1 (0.33) L3MBTL1TDP1ALDH1A1HPGDUSP2

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
CN-114149305-B Preparation method of haloalkyl-2, 3-dihydro-1H-indene-5-ol 西安彩晶光电科技股份有限公司 2023-12-22 CN disclosed
CN-114149305-A Preparation method of halogenated alkyl-2, 3-dihydro-1H-indole-5-alcohol 西安彩晶光电科技股份有限公司 2022-03-08 CN disclosed
US-9163178-B2 Liquid crystal compound with negative dielectric anisotropy, liquid crystal display, and optoelectronic device INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2015-10-20 US disclosed
US-9163178-B2 Liquid crystal compound with negative dielectric anisotropy, liquid crystal display, and optoelectronic device INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2015-10-20 US disclosed
US-20150124210-A1 LIQUID CRYSTAL COMPOUND WITH NEGATIVE DIELECTRIC ANISOTROPY, LIQUID CRYSTAL DISPLAY, AND OPTOELECTRONIC DEVICE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2015-05-07 US disclosed
US-20150124210-A1 LIQUID CRYSTAL COMPOUND WITH NEGATIVE DIELECTRIC ANISOTROPY, LIQUID CRYSTAL DISPLAY, AND OPTOELECTRONIC DEVICE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2015-05-07 US disclosed