SCHEMBL3475700

SCHEMBL3475700

CN(C)C(CCl)CN1c2ccccc2Sc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 7/20 0.65
CHRM2 P08172 6/20 0.65
HTR1A P08908 6/20 0.65
CHRM1 P11229 6/20 0.65
ADRA1A P35348 6/20 0.65
OPRM1 P35372 6/20 0.65
DRD3 P35462 6/20 0.65
KCNH2 Q12809 6/20 0.65
ADRA2A P08913 5/20 0.65
DRD1 P21728 5/20 0.65
SLC6A2 P23975 4/20 0.65
SLC6A4 P31645 4/20 0.65
LMNA P02545 4/20 0.65
PTGS1 P23219 4/20 0.65
ALDH1A1 P00352 4/20 0.65
CYP1A2 P05177 4/20 0.65
ALOX15 P16050 3/20 0.65
HSD17B10 Q99714 3/20 0.65
SLC22A1 O15245 3/20 0.65
DRD2 P14416 3/20 0.65

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
Hydrochloric Acid SCHEMBL8050972 0.98 LMNA (0.66) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Aminopromazine SCHEMBL25156 0.84 CHRM2 (0.70) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Aminopromazine SCHEMBL30990818 0.84 CHRM2 (0.70) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Aminopromazine SCHEMBL5307944 0.83 CHRM2 (0.68) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Bromide SCHEMBL22588344 0.82 CYP2D6 (0.66) CYP2D6CHRM2HTR1ACHRM1ADRA1A
SCHEMBL7344075 0.81 CYP2D6 (0.60) CYP2D6CHRM2HTR1ACHRM1ADRA1A
(S)-Promethazine SCHEMBL2900853 0.79 CYP2D6 (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
SCHEMBL6883388 0.79 CHRM2 (0.67) CYP2D6CHRM2HTR1ACHRM1ADRA1A
Promethazine SCHEMBL26777 0.79 CYP2D6 (1.00) CYP2D6CHRM2HTR1ACHRM1ADRA1A
SCHEMBL6879961 0.79 CHRM2 (0.67) CYP2D6CHRM2HTR1ACHRM1ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117561081-A Application of CYP450 inhibitor in inhibiting or killing mites and treating xerophthalmia 广州珍实视界生物医药科技有限公司 2024-02-13 CN claimed
EP-0969845-B1 NEW THERAPEUTIC COMBINATIONS OF MIRTAZAPINE AND ANTIPSYCHOTIC AGENTS, FOR THE TREATMENT OR PROPHYLAXIS OF PSYCHOTIC DISORDERS AKZO NOBEL NV (NL) 2006-03-01 EP claimed
US-6150353-A USE OF MIRTAZAPINE AND AN ANTIPSYCHOTIC DRUG COMBINATIONS ENHANCES THEEFFECT OF THE ANTIPSYCHOTIC AGENT TO BE USED AND ALLOW BETTER MANAGEMENT OF DRUG RELATED TOXICITY AND SIDE EFFECT AKZO NOBEL N.V. (NL) 2000-11-21 US claimed
US-6140324-A ADMINISTERING TACHYKININ ANTAGONIST AND MUSCARINIC ANTAGONIST AND/OR ANTIHISTAMINE, SUCH THAT THEY GIVE EFFECTIVE RELIEF FROM MOTION SICKNESS MERCK SHARP & DOHME LTD. (GB) 2000-10-31 US claimed
EP-0969845-A1 NEW THERAPEUTIC COMBINATIONS OF MIRTAZAPINE AND ANTIPSYCHOTIC AGENTS, FOR THE TREATMENT OR PROPHYLAXIS OF PSYCHOTIC DISORDERS Akzo Nobel N.V. (NL) 2000-01-12 EP claimed
WO-1998043646-A1 NEW THERAPEUTIC COMBINATIONS OF MIRTAZAPINE AND ANTIPSYCHOTIC AGENTS, FOR THE TREATMENT OR PROPHYLAXIS OF PSYCHOTIC DISORDERS AKZO NOBEL N.V. (NL) 1998-10-08 WO claimed
WO-1997002824-A1 USE OF A TACHYKININ ANTAGONIST AND A MUSCARINIC ANTAGONIST AND/OR AN ANTIHISTAMINE TO TREAT MOTION SICKNESS MERCK SHARP & DOHME LIMITED (GB) 1997-01-30 WO claimed
CN-111246873-B Optimized peptides for targeting human nerves and their use in image guided surgery, diagnosis and therapy delivery 加利福尼亚大学董事会 2024-03-01 CN disclosed
CN-111902143-B Inhibitors of calcium concentration increase in nerve cells 东丽株式会社 2024-01-02 CN disclosed
CN-117241786-A Method for preparing dry powder by using film freezing based on suspension 德克萨斯大学系统董事会 2023-12-15 CN disclosed
CN-117138051-A Silica gel material, preparation method thereof, silica gel tube and implant containing silica gel tube 沈阳药科大学 2023-12-01 CN disclosed
CN-117017897-A Implant and method for testing drug release amount thereof 沈阳药科大学 2023-11-10 CN disclosed
CN-116808314-A Silica gel material, preparation method thereof, silica gel tube and implant containing silica gel tube 沈阳药科大学 2023-09-29 CN disclosed
WO-2010126953-A1 CORTICOSTEROID LINKED BETA-AGONIST COMPOUNDS FOR USE IN THERAPY GILEAD SCIENCES, INC. (US) 2010-11-04 WO disclosed
US-20070166364-A1 Transdermal Therapeutic System BEIER CORNELIA 2007-07-19 US disclosed
US-7220473-B2 Storage stability HEXAL AG (DE) 2007-05-22 US disclosed
US-20040047901-A1 Storage stability HEXAL AG (DE) 2004-03-11 US disclosed
EP-0173729-B1 PROCESS FOR SOLUBILIZING ACTIVE PRINCIPLES AND PHARMACEUTICAL COMPOSITIONS THUS OBTAINED CORBIERE, Jérôme (FR) 1990-10-17 EP disclosed
EP-0173729-A1 PROCESS FOR SOLUBILIZING ACTIVE PRINCIPLES AND PHARMACEUTICAL COMPOSITIONS THUS OBTAINED. CORBIERE JEROME 1986-03-12 EP disclosed
WO-1985004106-A1 PROCESS FOR SOLUBILIZING ACTIVE PRINCIPLES AND PHARMACEUTICAL COMPOSITIONS THUS OBTAINED CORBIERE JEROME 1985-09-26 WO disclosed