SCHEMBL14775411

SCHEMBL14775411

Cc1ccc(C(CCc2cc[nH]c2)N2CCOCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
POLB P06746 2/20 0.41
P2RX7 Q99572 2/20 0.41
TP53 P04637 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
SLC6A4 P31645 3/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A3 Q01959 2/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CCR3 P51677 1/20 0.36
ALDH1A1 P00352 3/20 0.35
ATM Q13315 1/20 0.35
KDM4E B2RXH2 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
SCHEMBL14775441 0.74 SLC6A2 (0.51) MAPTPOLBP2RX7TP53HRH3
SCHEMBL14775366 0.73 SLC6A2 (0.67) MAPTPOLBP2RX7TP53HRH3
SCHEMBL15797503 0.72 DPP4 (0.53) MAPTPOLBP2RX7TP53HRH3
SCHEMBL11989196 0.70 MAPT (0.47) MAPTPOLBP2RX7TP53HRH3
SCHEMBL28870160 0.69 CCR3 (0.63) SLC6A4SLC6A3MEN1KMT2ACCR3
SCHEMBL22458852 0.65 KMT2A (0.45) POLBP2RX7TP53MEN1KMT2A
SCHEMBL13561473 0.64 P2RX7 (0.50) MAPTPOLBP2RX7SLC6A4SLC6A2
SCHEMBL7854201 0.64 SMN1; SMN2 (0.45) MAPTPOLBP2RX7TP53LMNA
SCHEMBL259780 0.64 HRH3 (0.56) MAPTHRH3LMNAMEN1KMT2A
SCHEMBL11989937 0.64 OPRM1 (0.58) SLC6A4SLC6A2SLC6A3LMNAALDH1A1

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 4 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 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 MAPT 612/4885POLB 2207/4885P2RX7 175/4885

“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.