SCHEMBL20118296

SCHEMBL20118296

CCCCC1CCC(c2ccc(-c3ccc(-c4ccccc4)cc3F)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 4/20 0.43
CYP3A4 P08684 3/20 0.43
APP P05067 2/20 0.41
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 3/20 0.36
MAPK1 P28482 3/20 0.36
KMT2A Q03164 3/20 0.36
GAA P10253 2/20 0.36
ESR2 Q92731 3/20 0.36
P2RY14 Q15391 2/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
RARB P10826 1/20 0.36
DGAT1 O75907 1/20 0.35
CYP1A2 P05177 1/20 0.35
HPGD P15428 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
SCHEMBL20118299 0.93 CYP2C9 (0.45) CYP2C9CYP3A4APPCYP2D6CYP2C19
SCHEMBL21902209 0.91 CYP2C9 (0.41) CYP2C9CYP3A4APPCYP2D6CYP2C19
SCHEMBL21902217 0.89 CYP2C9 (0.40) CYP2C9CYP3A4APPCYP2D6CYP2C19
SCHEMBL19850831 0.89 CYP2C9 (0.40) CYP2C9CYP3A4APPCYP2D6CYP2C19
SCHEMBL11113421 0.89 CYP2C9 (0.44) CYP2C9CYP3A4APPCYP2D6CYP2C19
SCHEMBL11113415 0.89 CYP2C9 (0.44) CYP2C9CYP3A4APPCYP2D6CYP2C19
SCHEMBL20118301 0.88 SPHK1 (0.44) CYP2C9CYP3A4RARB
SCHEMBL21902221 0.88 SPHK1 (0.44) CYP2C9CYP3A4RARB
SCHEMBL16377238 0.88 SPHK1 (0.41) CYP2C9CYP3A4RARB
SCHEMBL12920151 0.88 SPHK1 (0.41) CYP2C9CYP3A4RARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11162028-B2 Liquid crystal composition and application thereof JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2021-11-02 US disclosed
US-20210017450-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE HAVING SAME JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2021-01-21 US disclosed
US-20200339884-A1 LIQUID CRYSTAL COMPOSITION AND USE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2020-10-29 US disclosed
US-20200123442-A1 LIQUID CRYSTAL COMPOSITION AND APPLICATION THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2020-04-23 US disclosed
US-20180119011-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2018-05-03 US disclosed