SCHEMBL6418906

SCHEMBL6418906

CCCCN(C(=O)c1ccc2ccccc2c1)[C@@H]1CCN(C(=O)C(F)(F)F)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.53
KCNH2 Q12809 2/20 0.53
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SLC6A2 P23975 3/20 0.41
SLC6A3 Q01959 3/20 0.41
KDM5A P29375 1/20 0.40
MCHR1 Q99705 1/20 0.40
CCR1 P32246 1/20 0.40
CCKBR P32239 1/20 0.39
UBE2M P61081 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.39
BCHE P06276 4/20 0.39
DRD4 P21917 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL6431531 0.85 SLC6A4 (0.58) SLC6A4KCNH2NPC1RAB9ASLC6A2
SCHEMBL4634065 0.85 SLC6A4 (0.58) SLC6A4KCNH2NPC1RAB9ASLC6A2
SCHEMBL6431527 0.85 SLC6A4 (0.58) SLC6A4KCNH2NPC1RAB9ASLC6A2
SCHEMBL6410766 0.85 SLC6A4 (0.48) SLC6A4KCNH2NPC1RAB9ASLC6A2
SCHEMBL6414218 0.84 CHRM2 (0.47) SLC6A4KCNH2UBE2MDCUN1D1DRD4
SCHEMBL4634827 0.83 C5AR1 (0.43) UBE2MDCUN1D1
SCHEMBL6415646 0.81 ALDH1A1 (0.40) SLC6A4KCNH2SLC6A2SLC6A3MCHR1
SCHEMBL4634432 0.74 SLC6A4 (0.76) SLC6A4KCNH2SLC6A2SLC6A3
SCHEMBL6412856 0.74 SLC6A4 (0.76) SLC6A4KCNH2SLC6A2SLC6A3
SCHEMBL6439473 0.74 SLC6A4 (0.53) SLC6A4KCNH2NPC1RAB9ASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors PFIZER INC 2005-01-20 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 (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-20050014789-A1 Amide derivatives as selective serotonin re-uptake inhibitors SLC6A4, HTR3C, HTR3A SLC6A4 1/4885KCNH2 754/4885NPC1 193/4885

“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.