SCHEMBL14775368

SCHEMBL14775368

CN(CCC(c1cc2ccccc2s1)N1CCOCC1)Cc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.77
SLC6A4 P31645 7/20 0.77
SLC6A3 Q01959 5/20 0.61
ACKR3 P25106 1/20 0.41
DRD1 P21728 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TACR2 P21452 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
GAA P10253 1/20 0.35
AOC3 Q16853 1/20 0.35
DRD2 P14416 1/20 0.35
DRD3 P35462 1/20 0.35
KCNH2 Q12809 1/20 0.35

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 SCHEMBL14775487 0.99 SLC6A2 (0.75) SLC6A2SLC6A4SLC6A3ACKR3DRD1
SCHEMBL14775382 0.90 SLC6A2 (0.75) SLC6A2SLC6A4SLC6A3ACKR3DRD1
Hydrochloric Acid SCHEMBL14775055 0.89 SLC6A2 (0.73) SLC6A2SLC6A4SLC6A3ACKR3DRD1
SCHEMBL14775624 0.89 SLC6A2 (0.73) SLC6A2SLC6A4SLC6A3ACKR3DRD1
Hydrochloric Acid SCHEMBL14775446 0.88 SLC6A2 (0.72) SLC6A2SLC6A4SLC6A3ACKR3DRD1
SCHEMBL14775454 0.87 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3L3MBTL1
SCHEMBL14775515 0.81 SLC6A2 (0.48) SLC6A2SLC6A4L3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL14775638 0.80 SLC6A2 (0.47) SLC6A2SLC6A4L3MBTL1MEN1KMT2A
SCHEMBL14775525 0.78 SLC6A2 (0.71) SLC6A2SLC6A4SLC6A3DRD1L3MBTL1
SCHEMBL14775100 0.77 SLC6A4 (0.77) SLC6A2SLC6A4SLC6A3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2570409-B1 ARALKYL DIAMINE DERIVATIVES AND USES THEREOF AS ANTIDEPRESSANT SHANGHAI INST PHARM INDUSTRY (CN) 2015-07-08 EP claimed
US-8962621-B2 Aralkyl diamine derivatives and uses thereof as antidepressants SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-02-24 US claimed
US-20130072488-A1 ARALKYL DIAMINE DERIVATIVES AND USES THEREOF AS ANTIDEPRESSANTS SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2013-03-21 US claimed
EP-2570409-A1 ARALKYL DIAMINE DERIVATIVES AND USES THEREOF AS ANTIDEPRESSANT Shanghai Institute of Pharmaceutical Industry (CN) 2013-03-20 EP claimed
EP-2570409-B1 ARALKYL DIAMINE DERIVATIVES AND USES THEREOF AS ANTIDEPRESSANT SHANGHAI INST PHARM INDUSTRY (CN) 2015-07-08 EP disclosed
US-8962621-B2 Aralkyl diamine derivatives and uses thereof as antidepressants SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-02-24 US disclosed
US-20130072488-A1 ARALKYL DIAMINE DERIVATIVES AND USES THEREOF AS ANTIDEPRESSANTS SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2013-03-21 US disclosed
EP-2570409-A1 ARALKYL DIAMINE DERIVATIVES AND USES THEREOF AS ANTIDEPRESSANT Shanghai Institute of Pharmaceutical Industry (CN) 2013-03-20 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 (1 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-20130072488-A1 ARALKYL DIAMINE DERIVATIVES AND USES THEREOF AS ANTIDEPRESSANTS MAOA, SLC6A2, MAOB SLC6A2 2/4885SLC6A4 5/4885SLC6A3 4/4885

“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.