SCHEMBL6414218

SCHEMBL6414218

O=C(c1ccc2ccccc2c1)N(Cc1ccccc1)[C@@H]1CCN(C(=O)C(F)(F)F)C1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.47
CHRM3 P20309 1/20 0.47
DRD4 P21917 6/20 0.47
AGER Q15109 3/20 0.45
MTNR1A P48039 1/20 0.45
DRD2 P14416 1/20 0.44
DRD3 P35462 1/20 0.44
OPRM1 P35372 1/20 0.43
HSD11B1 P28845 1/20 0.42
UBE2M P61081 1/20 0.42
DCUN1D1 Q96GG9 1/20 0.42
SLC6A12 P48065 1/20 0.42
SLC6A13 Q9NSD5 1/20 0.42
SLC6A4 P31645 1/20 0.42
KCNH2 Q12809 1/20 0.42
HSD17B10 Q99714 1/20 0.41

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) DRD4SLC6A4KCNH2
SCHEMBL4634065 0.85 SLC6A4 (0.58) DRD4SLC6A4KCNH2
SCHEMBL6431527 0.85 SLC6A4 (0.58) DRD4SLC6A4KCNH2
SCHEMBL6418906 0.84 SLC6A4 (0.53) DRD4UBE2MDCUN1D1SLC6A4KCNH2
SCHEMBL6410766 0.83 SLC6A4 (0.48) DRD4UBE2MDCUN1D1SLC6A4KCNH2
SCHEMBL25090900 0.78 MEN1 (0.46) CHRM2CHRM3OPRM1HSD11B1UBE2M
SCHEMBL24424433 0.78 MEN1 (0.46) CHRM2CHRM3OPRM1HSD11B1UBE2M
SCHEMBL4635081 0.75 PDK2 (0.45) CHRM2CHRM3AGERKCNH2
SCHEMBL4635628 0.72 CHRM2 (0.68) CHRM2CHRM3DRD4OPRM1SLC6A12
SCHEMBL4634737 0.72 CHRM2 (0.68) CHRM2CHRM3DRD4OPRM1SLC6A12

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 CHRM2 178/4885CHRM3 219/4885DRD4 43/4885

“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.