SCHEMBL2615239

SCHEMBL2615239

O=C(NCCN1CCOCC1)c1ccc(F)cc1

nearest known ligand 0.92

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 7/20 0.92
EPHX2 P34913 2/20 0.83
SMN1; SMN2 Q16637 1/20 0.77
ALDH1A1 P00352 1/20 0.75
HTR1A P08908 1/20 0.75
MAOA P21397 1/20 0.75
MAOB P27338 1/20 0.75
KCNH2 Q12809 1/20 0.75
HPGD P15428 1/20 0.71
LMNA P02545 1/20 0.67
POLB P06746 1/20 0.66
KDM4E B2RXH2 1/20 0.66

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
SCHEMBL2615238 1.00 CD274 (0.92) CD274EPHX2SMN1; SMN2ALDH1A1HTR1A
SCHEMBL6569882 0.87 CD274 (0.77) CD274EPHX2ALDH1A1HTR1AMAOA
SCHEMBL4488493 0.87 CD274 (0.77) CD274EPHX2ALDH1A1HTR1AMAOA
SCHEMBL11479065 0.86 CD274 (0.93) CD274EPHX2ALDH1A1HTR1AMAOA
Moclobemide SCHEMBL3408310 0.86 CD274 (1.00) CD274EPHX2SMN1; SMN2ALDH1A1HTR1A
SCHEMBL3543817 0.86 CD274 (0.92) CD274EPHX2ALDH1A1HTR1AMAOA
SCHEMBL280240 0.86 MEN1 (0.76) CD274ALDH1A1HTR1AMAOAMAOB
SCHEMBL6034019 0.86 TSHR (0.85) CD274EPHX2ALDH1A1HTR1AMAOA
Moclobemide SCHEMBL49708 0.86 CD274 (1.00) CD274EPHX2SMN1; SMN2ALDH1A1HTR1A
SCHEMBL1512746 0.86 CD274 (0.75) CD274EPHX2ALDH1A1HTR1AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122005693-A Application of Jiaweidanzhi Xiaoyao powder or extract thereof in preparation of medicines for treating depression complicated with ulcerative colitis 河南中医药大学 2026-05-12 CN claimed
US-20020032197-A1 Methods and compositions for using moclobemide VELA PHARMACEUTICALS, INC. 2002-03-14 US claimed
WO-2000006138-A2 USE OF MOCLOBEMIDE FOR TREATING PAIN AND OTHER DISEASES VELA PHARMACEUTICALS INC. (US) 2000-02-10 WO claimed
WO-2000006139-A2 USE OF MOCLOBEMIDE AND METABOLITES FOR TREATING AND PREVENTING SUBSTANCE ABUSE VELA PHARMACEUTICALS INC. (US) 2000-02-10 WO claimed
US-4210754-A ANTIDEPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1980-07-01 US claimed
CN-122005693-A Application of Jiaweidanzhi Xiaoyao powder or extract thereof in preparation of medicines for treating depression complicated with ulcerative colitis 河南中医药大学 2026-05-12 CN disclosed
US-20120095217-A1 FLUORINE CONTAINING COMPOUNDS AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2012-04-19 US disclosed
US-20120095217-A1 FLUORINE CONTAINING COMPOUNDS AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2012-04-19 US disclosed
WO-2010081036-A2 FLUORINE CONTAINING COMPOUNDS AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-07-15 WO disclosed
US-20020032197-A1 Methods and compositions for using moclobemide VELA PHARMACEUTICALS, INC. 2002-03-14 US disclosed
WO-2000006140-A2 USE OF MOCLOBEMIDE FOR TREATING CERTAIN PHSYCHIATRIC AND MEDICAL DISORDERS VELA PHARMACEUTICALS INC. (US) 2000-02-10 WO disclosed
WO-2000006139-A2 USE OF MOCLOBEMIDE AND METABOLITES FOR TREATING AND PREVENTING SUBSTANCE ABUSE VELA PHARMACEUTICALS INC. (US) 2000-02-10 WO disclosed
WO-2000006138-A2 USE OF MOCLOBEMIDE FOR TREATING PAIN AND OTHER DISEASES VELA PHARMACEUTICALS INC. (US) 2000-02-10 WO disclosed
US-4210754-A ANTIDEPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1980-07-01 US 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 (2 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-20020032197-A1 Methods and compositions for using moclobemide FKBP5, FKBP1B, FKBP3 CD274 2615/4885EPHX2 3022/4885SMN1; SMN2 1223/4885
US-20120095217-A1 FLUORINE CONTAINING COMPOUNDS AND METHODS OF USE THEREOF FLI1, CDC73, FOS CD274 4742/4885EPHX2 1901/4885SMN1; SMN2 888/4885

“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.