SCHEMBL4784319

SCHEMBL4784319

NC1(c2ccc(Cl)c(Cl)c2)CCCc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.46
SLC6A4 P31645 12/20 0.44
SLC6A3 Q01959 11/20 0.44
SLC6A2 P23975 6/20 0.43
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SIGMAR1 Q99720 1/20 0.38

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 SCHEMBL7755304 0.98 KDM1A (0.45) KDM1ASLC6A4SLC6A3SLC6A2MEN1
SCHEMBL11696762 0.80 KDM1A (0.54) KDM1AMEN1KMT2ASIGMAR1
SCHEMBL7378848 0.78 SLC6A4 (0.46) KDM1ASLC6A4SLC6A3SLC6A2
SCHEMBL7546727 0.78 SLC6A4 (0.46) KDM1ASLC6A4SLC6A3SLC6A2
SCHEMBL18228175 0.77 KDM1A (0.38) KDM1AMEN1KMT2ASIGMAR1
Hydrochloric Acid SCHEMBL7949501 0.77 SLC6A4 (0.45) KDM1ASLC6A4SLC6A3SLC6A2
SCHEMBL16404981 0.77 TRPV3 (0.40) KDM1ASLC6A4SLC6A3SLC6A2
SCHEMBL7984137 0.72 KDM1A (0.50) KDM1AMEN1KMT2A
SCHEMBL7948379 0.72 SLC6A4 (0.43) KDM1ASLC6A4SLC6A3SLC6A2KMT2A
SCHEMBL9545809 0.72 SLC6A4 (0.43) KDM1ASLC6A4SLC6A3SLC6A2

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
US-20140315910-A1 Combinations of Eszopiclone and Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-N-Methyl-1-Napthalenamine or Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-1-Napthalenamine, and Methods of Treatment of Menopause and Mood, Anxiety, and Cognitive Disorders SEPRACOR INC. 2014-10-23 US disclosed
US-20130065904-A1 Combinations of Eszopiclone and Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-N-Methyl-1-Napthalenamine or Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-1-Napthalenamine, and Methods of Treatment of Menopause and Mood, Anxiety, and Cognitive Disorders SUNOVION PHARMACEUTICALS INC. (US) 2013-03-14 US disclosed
US-20080293726-A1 Combinations of Eszopiclone and Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-N-Methyl-1-Napthalenamine or Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-1-Napthalenamine, and Methods of Treatment of Menopause and Mood, Anxiety, and Cognitive Disorders SEPRACOR INC. (US) 2008-11-27 US disclosed
WO-2008065177-A1 PROCESSES FOR PREPARING DESMETHYLSERTRALINE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF CEREP (FR) 2008-06-05 WO disclosed
EP-1904045-A1 USE OF 4-(3,4-DICHLORO-PHENYL)-1,2,3,4-TETRAHYDRO-NAPHTALEN-1-YLAMINE FOR TREATING CANCER Anceris (FR) 2008-04-02 EP disclosed
EP-1904066-A2 COMBINATIONS OF ESZOPICLONE AND TRANS 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPTHALENAMINE OR TRANS 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-1-NAPTHALENAMINE, AND METHODS OF TREATMENT OF MENOPAUSE AND MOOD, ANXIETY, AND COGNITIVE DISORDERS Sepracor Inc. (US) 2008-04-02 EP disclosed
WO-2007006797-A1 USE OF 4-(3,4-DICHLORO-PHENYL)-1,2,3,4-TETRAHYDRO-NAPHTALEN-1-YLAMINE FOR TREATING CANCER ANCERIS (FR) 2007-01-18 WO disclosed
WO-2007006003-A2 COMBINATIONS OF ESZOPICLONE AND TRANS 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPTHALENAMINE OR TRANS 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-1-NAPTHALENAMINE, AND METHODS OF TREATMENT OF MENOPAUSE AND MOOD, ANXIETY, AND COGNITIVE DISORDERS SEPRACOR INC. (US) 2007-01-11 WO disclosed
EP-1157002-A1 1,2,3,4-TETRAHYDRO-1-NAPHTHALENAMINE COMPOUNDS USEFUL IN THERAPY Pfizer Limited (GB) 2001-11-28 EP disclosed
WO-2000051972-A1 1,2,3,4-TETRAHYDRO-1-NAPHTHALENAMINE COMPOUNDS USEFUL IN THERAPY PFIZER LIMITED (GB) 2000-09-08 WO disclosed
EP-0341015-A2 Improved process for preparing a ketimine PFIZER INC. (US) 1989-11-08 EP disclosed
EP-0295050-A1 Process for preparing a 4,4-diphenylbutanoic acid derivative PFIZER INC. (US) 1988-12-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140315910-A1 Combinations of Eszopiclone and Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-N-Methyl-1-Napthalenamine or Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-1-Napthalenamine, and Methods of Treatment of Menopause and Mood, Anxiety, and Cognitive Disorders HTR4, HTR2C, HTR1D KDM1A 642/4885SLC6A4 38/4885SLC6A3 114/4885
US-20130065904-A1 Combinations of Eszopiclone and Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-N-Methyl-1-Napthalenamine or Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-1-Napthalenamine, and Methods of Treatment of Menopause and Mood, Anxiety, and Cognitive Disorders HTR4, HTR2C, HTR1D KDM1A 642/4885SLC6A4 38/4885SLC6A3 114/4885
US-20080293726-A1 Combinations of Eszopiclone and Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-N-Methyl-1-Napthalenamine or Trans 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-1-Napthalenamine, and Methods of Treatment of Menopause and Mood, Anxiety, and Cognitive Disorders HTR4, HTR2C, HTR1D KDM1A 642/4885SLC6A4 38/4885SLC6A3 114/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.