SCHEMBL5484311

SCHEMBL5484311

[CH2]C[C@@H](CCC)Oc1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 11/20 0.46
SLC6A2 P23975 10/20 0.46
HTR1B P28222 3/20 0.43
HTR1D P28221 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
SLC6A3 Q01959 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
SCHEMBL5473673 1.00 SLC6A4 (0.46) SLC6A4SLC6A2HTR1BHTR1DKDM4E
SCHEMBL5715049 0.90 SLC6A4 (0.50) SLC6A4SLC6A2HTR1BHTR1DKDM4E
SCHEMBL28054515 0.84 SLC6A4 (0.46) SLC6A4SLC6A2HTR1BHTR1DKDM4E
SCHEMBL14542614 0.83 SLC6A4 (0.45) SLC6A4SLC6A2HTR1BHTR1DKDM4E
SCHEMBL9477676 0.81 MCHR1 (0.51) SLC6A4SLC6A2HTR1BHTR1DKDM4E
SCHEMBL8536438 0.81 SLC6A4 (0.48) SLC6A4SLC6A2HTR1BHTR1DKDM4E
SCHEMBL5475476 0.81 SLC6A4 (0.63) SLC6A4SLC6A2HTR1BHTR1DCYP1A2
SCHEMBL5475484 0.81 SLC6A4 (0.63) SLC6A4SLC6A2HTR1BHTR1DCYP1A2
SCHEMBL5475481 0.81 SLC6A4 (0.63) SLC6A4SLC6A2HTR1BHTR1DCYP1A2
Hydrochloric Acid SCHEMBL5476212 0.80 SLC6A4 (0.61) SLC6A4SLC6A2HTR1BHTR1DCYP1A2

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-20070072859-A1 Pharmaceutical compounds ELI LILLY AND COMPANY (US) 2007-03-29 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-20070072859-A1 Pharmaceutical compounds ADRB3, HTR3C, SLC6A2 SLC6A4 15/4885SLC6A2 3/4885HTR1B 80/4885

“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.