SCHEMBL49212

SCHEMBL49212

c1ccc2c([N]c3cccc4ccccc34)cccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
CYP1A2 P05177 5/20 0.58
HSD17B10 Q99714 4/20 0.58
HPGD P15428 3/20 0.58
CYP3A4 P08684 3/20 0.58
TDP1 Q9NUW8 2/20 0.58
ABCB11 O95342 1/20 0.58
NR3C1 P04150 1/20 0.58
ADRA2A P08913 1/20 0.58
ADORA3 P0DMS8 1/20 0.58
ALOX15 P16050 1/20 0.58
ADRA2C P18825 1/20 0.58
MAOA P21397 1/20 0.58
DRD1 P21728 1/20 0.58
SLC6A4 P31645 1/20 0.58
HTR2B P41595 1/20 0.58
CCR2 P41597 1/20 0.58
CYP2A6 P11509 3/20 0.50
TSHR P16473 2/20 0.50
THRB P10828 1/20 0.48

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
SCHEMBL6541655 0.89 HPRT1 (0.61) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL5012433 0.87 ALDH1A1 (0.58) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL2254008 0.87 SIGMAR1 (0.49) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL6541278 0.85 HPRT1 (0.64) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL7751770 0.85 CYP1A2 (0.50) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL2328165 0.85 HPRT1 (0.64) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL69928 0.85 CYP1A2 (0.50) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL7650795 0.83 CYP1A2 (0.58) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL2291745 0.83 CYP1A2 (0.58) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4
SCHEMBL5010144 0.83 SIGMAR1 (0.51) ALDH1A1CYP1A2HSD17B10HPGDCYP3A4

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

Appears in 2185 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118063494-A Organic electroluminescent compound with core structure of boron-containing polycyclic aza-aromatic hydrocarbon and application thereof 吉林省元合电子材料有限公司 2024-05-24 CN claimed
CN-113121584-B Heterocyclic compound and organic electroluminescent device comprising same 武汉尚赛光电科技有限公司 2024-05-14 CN claimed
US-11800785-B2 Material for organic device and organic electroluminescent device using the same KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-10-24 US claimed
CN-114773347-B Benzimidazole compound based on ortho-substitution and application thereof 宁波卢米蓝新材料有限公司 2023-08-25 CN claimed
CN-114773347-A Benzimidazole compound based on ortho-substitution and application thereof 宁波卢米蓝新材料有限公司 2022-07-22 CN claimed
CN-114736208-A Benzimidazole compound based on multi-donor substitution and application thereof 宁波卢米蓝新材料有限公司 2022-07-12 CN claimed
CN-114507219-A Organic compound based on naphthalimide and application thereof 宁波卢米蓝新材料有限公司 2022-05-17 CN claimed
US-20210359216-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2021-11-18 US claimed
US-20210328154-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 US claimed
CN-113321659-A Organic electroluminescent material and device thereof 武汉尚赛光电科技有限公司 2021-08-31 CN claimed
US-20040133004-A1 Rhodium and iridium complexes MERCK PATENT GMBH (DE) 2004-07-08 US claimed
EP-1379534-A1 RHODIUM AND IRIDIUM COMPLEXES Covion Organic Semiconductors GmbH (DE) 2004-01-14 EP claimed
WO-2002081488-A1 RHODIUM AND IRIDIUM COMPLEXES COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2002-10-17 WO claimed
EP-0736009-B1 N-OXIDES OF 4-ARYLPIPERAZINES AND 4-ARYLPIPERIDINES AS ANTIPSYCHOTIC DRUGS ORTHO PHARMA CORP (US) 2002-09-11 EP claimed
EP-0560722-B1 Chromogenic lactam compounds, their production and use CIBA SC HOLDING AG (CH) 1999-11-17 EP claimed
EP-0220735-A2 3(2H)-pyridazinone derivatives, a process and intermediates for preparing them and medicaments containing them and/or other 3(2H)-pyridazinone derivatives RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1987-05-06 EP claimed
US-4104301-A BLOWING AGENTS ARMSTRONG CORK COMPANY (US) 1978-08-01 US claimed
US-4021428-A 4-Piperidino-5-oxo-2-pyrazolines FUJI PHOTO FILM CO., LTD. (JA) 1977-05-03 US claimed
US-3956339-A 4-Pyridinio-5-pyrazolone salts, process for their preparation and their use FUJI PHOTO FILM CO., LTD. (JA) 1976-05-11 US claimed
US-3946011-A S-Triazine tetracarboxylic acids and dianhydrides CIBA-GEIGY CORPORATION (US) 1976-03-23 US claimed