SCHEMBL6416461

SCHEMBL6416461

CCOc1ccc(Cl)c(CC2CCN(CC3CN(c4ccccc4)C(=O)S3)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.46
SLC6A4 P31645 6/20 0.46
CYP2D6 P10635 1/20 0.41
HRH1 P35367 5/20 0.37
CCR3 P51677 5/20 0.37
KCNH2 Q12809 3/20 0.37
MAOB P27338 3/20 0.37
MAPT P10636 2/20 0.35
PKM P14618 1/20 0.35
MAPK1 P28482 1/20 0.35
ACHE P22303 1/20 0.35
ALDH1A1 P00352 2/20 0.34
ATM Q13315 1/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL6411958 0.93 HTR1A (0.41) HTR1ASLC6A4CYP2D6MAOBMAPT
SCHEMBL6410869 0.92 HTR1A (0.46) HTR1ASLC6A4CYP2D6MAPTALDH1A1
SCHEMBL6414071 0.91 HTR1A (0.57) HTR1ASLC6A4POLB
SCHEMBL6418034 0.90 HTR1A (0.46) HTR1ASLC6A4CYP2D6
SCHEMBL6417947 0.89 HTR1A (0.46) HTR1ASLC6A4CYP2D6HRH1CCR3
SCHEMBL6418553 0.87 HTR1A (0.50) HTR1ASLC6A4CYP2D6HRH1CCR3
SCHEMBL6416360 0.86 SLC6A4 (0.40) HTR1ASLC6A4CCR3KCNH2MAPT
SCHEMBL6415069 0.85 HTR1A (0.52) HTR1ASLC6A4CCR3
SCHEMBL6417429 0.85 HTR1A (0.42) HTR1ASLC6A4CYP2D6HRH1CCR3
SCHEMBL6414313 0.84 HTR1A (0.49) HTR1ASLC6A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065140-A1 Serotonine reuptake inhibitor SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2005-03-24 US disclosed
EP-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 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-20050065140-A1 Serotonine reuptake inhibitor HTR1A, SLC6A4, SLC6A2 HTR1A 1/4885SLC6A4 2/4885CYP2D6 323/4885

“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.