SCHEMBL6086908

SCHEMBL6086908

Fc1ccc2[nH]cc(C3CCC(N4CCCC4)C3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 11/20 1.00
HTR1A P08908 5/20 0.60
DRD1 P21728 1/20 0.60
SLC6A2 P23975 1/20 0.60
HTR1B P28222 1/20 0.60
HTR2A P28223 1/20 0.60
SLC6A3 Q01959 1/20 0.60
OPRM1 P35372 1/20 0.56
OPRK1 P41145 1/20 0.56
OPRL1 P41146 1/20 0.56
HSD11B1 P28845 1/20 0.53

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
SCHEMBL7011235 0.91 SLC6A4 (0.84) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6087738 0.81 SLC6A4 (1.00) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL8109654 0.81 SLC6A4 (0.68) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6087082 0.81 SLC6A4 (1.00) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL8109656 0.79 OPRM1 (0.68) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6614077 0.79 SLC6A4 (0.65) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6793888 0.79 SLC6A4 (0.65) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6614074 0.79 SLC6A4 (0.65) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL6089024 0.79 SLC6A4 (0.65) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL3888648 0.79 SLC6A4 (0.66) SLC6A4HTR1ADRD1SLC6A2HTR1B

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-7049314-B2 Sexual disorders; antidepressants; attention deficit hyperactivity, obsessive-compulsive, and/or post-traumatic stress disorder; drug abuse and addiction BRISTOL-MYERS SQUIBB COMPANY (US) 2006-05-23 US claimed
US-20040077705-A1 Cyclopentyl indole derivatives BRISTOL-MYERS SQUIBB COMPANY 2004-04-22 US claimed

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-20040077705-A1 Cyclopentyl indole derivatives HTR5A, TPH1, TPH2 SLC6A4 11/4885HTR1A 4/4885DRD1 77/4885

“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.