SCHEMBL2565166

SCHEMBL2565166

Clc1ccc2c(ccc3ccccc32)c1Cl

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.78
HPRT1 P00492 4/20 0.64
ALDH1A1 P00352 4/20 0.55
HSD17B10 Q99714 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
TSHR P16473 1/20 0.55
PAX8 Q06710 1/20 0.52
MAPT P10636 2/20 0.52
LMNA P02545 2/20 0.52
MAPK1 P28482 2/20 0.52
CYP3A4 P08684 1/20 0.52
APEX1 P27695 1/20 0.52
PMP22 Q01453 1/20 0.52
CYP1A2 P05177 4/20 0.50
HIF1A Q16665 2/20 0.46
CYP1B1 Q16678 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 2/20 0.41
THRB P10828 1/20 0.41
MEN1 O00255 1/20 0.40

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
SCHEMBL449348 0.88 CYP2A6 (1.00) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
Benzene SCHEMBL27349922 0.86 CYP2A6 (0.95) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
Ammonia Solution, Strong SCHEMBL11476794 0.86 CYP2A6 (0.95) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
SCHEMBL9765602 0.84 CYP2A6 (0.67) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
SCHEMBL8268910 0.80 CYP2A6 (0.83) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
Ethylene SCHEMBL28814532 0.80 HPRT1 (0.88) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
Chrysene SCHEMBL384031 0.80 HPRT1 (1.00) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
SCHEMBL31177955 0.80 HPRT1 (1.00) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
Chrysene SCHEMBL27115 0.80 HPRT1 (1.00) CYP2A6HPRT1ALDH1A1HSD17B10TDP1
Chrysene SCHEMBL9786466 0.80 HPRT1 (1.00) CYP2A6HPRT1ALDH1A1HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108117508-A Spiro fluorene cycle compound, its application and use its hole mobile material and organic electroluminescence device 北京鼎材科技有限公司 2018-06-05 CN disclosed
CN-108117511-A Spiro fluorene cycle compound, its purposes and use its organic electroluminescence device 北京鼎材科技有限公司 2018-06-05 CN disclosed
CN-108117548-A Spiro fluorene cycle compound, its application and use its hot activation delayed fluorescence material and organic electroluminescence device 北京鼎材科技有限公司 2018-06-05 CN disclosed
CN-108117495-A Spiro fluorene cycle compound, its purposes and use its organic electroluminescence device 北京鼎材科技有限公司 2018-06-05 CN disclosed
CN-106242943-A A kind of luxuriant and rich with fragrance compounds and preparation technology thereof 四川大学 2016-12-21 CN disclosed
EP-2560937-A1 NOVEL m-TERPHENYL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME Canon Kabushiki Kaisha (JP) 2013-02-27 EP disclosed
WO-2011132624-A1 NOVEL m-TERPHENYL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-27 WO disclosed
US-20070191583-A1 Polymers based on 3,6-and 2,7-conjugated poly(phenanthrene) and pled devices MAX-PLANCK-SOCIETY (DE) 2007-08-16 US disclosed
US-20070152209-A1 Devices using polymers based on 3,6- and 2,7-conjugated poly(phenanthrene) E. I. DU PONT DE NEMOURS AND COMPANY 2007-07-05 US disclosed
EP-1066035-A4 SUBSTITUTED AROMATIC COMPOUNDS FOR TREATMENT OF ANTIBIOTIC RESISTANT INFECTIONS DEPT OF THE ARMY (US) 2001-05-09 EP disclosed
EP-1066035-A2 SUBSTITUTED AROMATIC COMPOUNDS FOR TREATMENT OF ANTIBIOTIC RESISTANT INFECTIONS Department of the Army, U.S. Governament U.S. Army Medical & Research and Materiel Command (US) 2001-01-10 EP disclosed
WO-1999048461-A2 SUBSTITUTED AROMATIC COMPOUNDS FOR TREATMENT OF ANTIBIOTIC RESISTANT INFECTIONS DEPARTMENT OF THE ARMY, U.S. GOVERNMENT (US) 1999-09-30 WO disclosed