SCHEMBL6668239

SCHEMBL6668239

CCC(CC)Oc1cc(-c2c(Cl)cc(Cl)cc2Cl)cc2c1O[C@H]1CCNC[C@@H]21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.32
SLC6A4 P31645 3/20 0.32
SLC6A3 Q01959 3/20 0.32
CYP2D6 P10635 1/20 0.32
HTR6 P50406 3/20 0.32
MET P08581 1/20 0.30

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
SCHEMBL6672051 1.00 SLC6A2 (0.32) SLC6A2SLC6A4SLC6A3CYP2D6HTR6
SCHEMBL6647589 0.91 SLC6A4 (0.33) SLC6A2SLC6A4SLC6A3HTR6MET
SCHEMBL6670842 0.91 SLC6A4 (0.33) SLC6A2SLC6A4SLC6A3HTR6MET
SCHEMBL6671182 0.89 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3CYP2D6HTR6
SCHEMBL6669463 0.89 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3CYP2D6HTR6
SCHEMBL6669495 0.89 CRHR1 (0.35) SLC6A2SLC6A4SLC6A3CYP2D6HTR6
SCHEMBL6799607 0.89 CRHR1 (0.35) SLC6A2SLC6A4SLC6A3CYP2D6HTR6
SCHEMBL6671587 0.87 HTR2C (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL6643679 0.87 HTR2C (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL6646243 0.85 HTR2C (0.37) SLC6A2SLC6A4SLC6A3CYP2D6HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6762191-B2 TREATING DISEASES FOR MODULATING OF 5-HT ACTIVITY, CENTRAL NERVOUS SYSTEM DISORDERS, ANXIETY, OBESITY, DEPRESSION, OR A STRESS-RELATED DISEASE PHARMACIA & UPJOHN COMPANY 2004-07-13 US claimed
EP-1404679-A2 (HETERO)ARYL SUBSTITUTED BENZOFURANS AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2004-04-07 EP claimed
US-20030050304-A1 Therapeutic compounds PHARMACIA & UPJOHN COMPANY 2003-03-13 US claimed
WO-2003004501-A2 (HETERO) ARYL SUBSTITUTED BENZOFURANS AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2003-01-16 WO claimed
US-20040214815-A1 Therapeutic compounds PHARMACIA & UPJOHN COMPANY 2004-10-28 US disclosed
US-6762191-B2 TREATING DISEASES FOR MODULATING OF 5-HT ACTIVITY, CENTRAL NERVOUS SYSTEM DISORDERS, ANXIETY, OBESITY, DEPRESSION, OR A STRESS-RELATED DISEASE PHARMACIA & UPJOHN COMPANY 2004-07-13 US disclosed
EP-1404679-A2 (HETERO)ARYL SUBSTITUTED BENZOFURANS AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2004-04-07 EP disclosed
US-20030050304-A1 Therapeutic compounds PHARMACIA & UPJOHN COMPANY 2003-03-13 US disclosed
WO-2003004501-A2 (HETERO) ARYL SUBSTITUTED BENZOFURANS AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2003-01-16 WO 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 (2 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-20040214815-A1 Therapeutic compounds HTR5A, HTR6, HTR1A SLC6A2 128/4885SLC6A4 47/4885SLC6A3 169/4885
US-20030050304-A1 Therapeutic compounds HTR5A, HTR6, HTR1A SLC6A2 128/4885SLC6A4 47/4885SLC6A3 169/4885

“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.