SCHEMBL6503216

SCHEMBL6503216

CC1C=C(c2c[nH]c3cc(F)ccc23)CCN1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 14/20 0.50
SLC6A4 P31645 2/20 0.43
DRD2 P14416 2/20 0.43
ADRA1D P25100 1/20 0.43
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
HTR2A P28223 1/20 0.42
OPRL1 P41146 1/20 0.42
HTR1A P08908 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
SCHEMBL6502167 0.86 TDO2 (0.45) TDO2SLC6A4DRD2ADRA1DHTR1D
SCHEMBL6501644 0.80 HTR1D (0.43) TDO2SLC6A4HTR1DHTR1BHTR2A
SCHEMBL6493361 0.79 HTR2A (0.39) HTR1DHTR1BHTR2A
SCHEMBL28097370 0.76 TDO2 (0.65) TDO2SLC6A4DRD2ADRA1DHTR1D
SCHEMBL21714635 0.73 HTR2A (0.51) SLC6A4HTR2AHTR1A
SCHEMBL6503299 0.72 TDO2 (0.46) TDO2SLC6A4
SCHEMBL28885288 0.70 DRD2 (0.46) TDO2SLC6A4DRD2ADRA1DHTR1D
SCHEMBL7865112 0.70 SLC6A4 (0.81) TDO2SLC6A4HTR1A
SCHEMBL6493987 0.69 DRD2 (0.55) SLC6A4DRD2ADRA1DHTR1DHTR1B
SCHEMBL18324732 0.68 TDO2 (0.81) TDO2SLC6A4DRD2HTR2AOPRL1

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-6844338-B2 Piperidyindoles as serotonin receptor ligands ELI LILLY AND COMPANY (US) 2005-01-18 US disclosed
US-20030225068-A1 Piperidyindoles as serotonin receptor ligands ELI LILLY AND COMPANY 2003-12-04 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-20030225068-A1 Piperidyindoles as serotonin receptor ligands CNR1, HTR1D, HTR1A TDO2 1463/4885SLC6A4 215/4885DRD2 16/4885

“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.