SCHEMBL7904596

SCHEMBL7904596

COc1ccc(C2CNCCc3c2cc(OC)c(OC)c3Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 8/20 0.50
HTR2B P41595 7/20 0.50
KDM4E B2RXH2 5/20 0.50
RECQL P46063 4/20 0.50
BLM P54132 3/20 0.50
DRD2 P14416 3/20 0.50
CYP3A4 P08684 2/20 0.50
CYP2D6 P10635 2/20 0.50
NFKB1 P19838 2/20 0.50
THPO P40225 2/20 0.50
HIF1A Q16665 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 1/20 0.50
CYP2C9 P11712 1/20 0.50
TSHR P16473 1/20 0.50
CYP2C19 P33261 1/20 0.50
KMT2A Q03164 1/20 0.50
KDM1A O60341 1/20 0.50
HTR1A P08908 1/20 0.50
ADRA2A P08913 1/20 0.50

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
SCHEMBL11204372 1.00 DRD1 (0.50) DRD1HTR2BKDM4ERECQLBLM
Bromide SCHEMBL10718013 0.99 KDM4E (0.51) DRD1HTR2BKDM4ERECQLBLM
SCHEMBL7325308 0.89 DRD1 (0.60) DRD1HTR2BKDM4ERECQLBLM
Hydrochloric Acid SCHEMBL11269253 0.88 DRD1 (0.59) DRD1HTR2BKDM4ERECQLBLM
SCHEMBL11270427 0.88 DRD1 (0.45) DRD1HTR2BKDM4ERECQLBLM
SCHEMBL11607365 0.88 DRD1 (0.47) DRD1HTR2BKDM4ERECQLBLM
SCHEMBL11607907 0.88 DRD1 (0.47) DRD1HTR2BKDM4ERECQLBLM
SCHEMBL11607370 0.87 DRD1 (0.47) DRD1HTR2BKDM4ERECQLBLM
Bromide SCHEMBL11257920 0.87 DRD1 (0.48) DRD1HTR2BKDM4ERECQLBLM
SCHEMBL11238141 0.86 DRD1 (0.43) DRD1HTR2BKDM4ERECQLBLM

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4321195-A 6-Halo-7,8-dimethoxy-1-(methoxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepines SMITHKLINE CORPORATION (US) 1982-03-23 US claimed
CN-120025295-A Difluoromethyl and amino substituted olefin compound and synthesis method thereof 浙江师范大学 2025-05-23 CN disclosed
EP-1082289-A4 METHODS FOR IDENTIFYING NOVEL MULTIMERIC AGENTS THAT MODULATE RECEPTORS ADVANCED MEDICINE INC (US) 2001-03-14 EP disclosed
EP-1082289-A1 METHODS FOR IDENTIFYING NOVEL MULTIMERIC AGENTS THAT MODULATE RECEPTORS Advanced Medicine, Inc. (US) 2001-03-14 EP disclosed
WO-1999066944-A9 METHODS FOR IDENTIFYING NOVEL MULTIMERIC AGENTS THAT MODULATE RECEPTORS ADVANCED MEDICINE INC (US) 2000-07-27 WO disclosed
WO-1999066944-A1 METHODS FOR IDENTIFYING NOVEL MULTIMERIC AGENTS THAT MODULATE RECEPTORS ADVANCED MEDICINE, INC. (US) 1999-12-29 WO disclosed
EP-0476156-B1 SOLID ORAL PREPARATION CONTAINING CATECHOL COMPOUND EISAI CO LTD (JP) 1996-08-07 EP disclosed
US-5292521-A And an organic acid or salt EISAI CO., LTD. (JP) 1994-03-08 US disclosed
EP-0476156-A1 SOLID ORAL PREPARATION CONTAINING CATECHOL COMPOUND Eisai Co., Ltd. (JP) 1992-03-25 EP disclosed
US-4782163-A 2-(2-halo-3,4-dimethoxybenzyl)-5-(4-methoxyphenyl)-oxazolidines SMITHKLINE BECKMAN CORPORATION (US) 1988-11-01 US disclosed
EP-0044709-A1 New dopaminergic benzazepines SMITHKLINE BECKMAN CORPORATION (US) 1982-01-27 EP disclosed
US-4285938-A HYPERTENSIVE AGENTS; BACTERICIDES; ANTIDEPRESSANTS; INCREASE RENAL BLOOD FLOW SMITHKLINE CORPORATION (US) 1981-08-25 US disclosed
EP-0027348-A1 7,8-Dihydroxy-1-(sulfamylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine derivatives, a process for their preparation and compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1981-04-22 EP disclosed
US-4251525-A FOR TREATING ANGINA PECTORIS SMITHKLINE CORPORATION (US) 1981-02-17 US disclosed
EP-0022330-A2 Synergistic antihypertensive compositions SMITHKLINE BECKMAN CORPORATION (US) 1981-01-14 EP disclosed
EP-0020107-A1 3-Allyl-7,8-dihydroxy-6-halo-1-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine derivatives, process for preparing them and compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1980-12-10 EP disclosed
US-4197297-A 6-Halo-7,8-dihydroxy-1-(hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepines SMITHKLINE CORPORATION (US) 1980-04-08 US disclosed
EP-0004794-A2 Substituted benzazepines, processes for preparing them and pharmaceutical compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1979-10-17 EP disclosed
US-4171359-A DOPAMINERGIC ACTIVITY SMITHKLINE CORPORATION (US) 1979-10-16 US disclosed
US-4160765-A Method for 6-bromination of 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine compounds SMITHKLINE CORPORATION (US) 1979-07-10 US disclosed