SCHEMBL6669768

SCHEMBL6669768

COc1cc(-c2c(F)cc(Cl)cc2F)cc2c1O[C@H]1CCNC[C@@H]21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.34
HTR2C P28335 6/20 0.34
FPR1 P21462 2/20 0.32
FPR2 P25090 1/20 0.32
HTR6 P50406 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HTR2B P41595 4/20 0.32
ALK Q9UM73 1/20 0.32

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
SCHEMBL6671716 1.00 HTR2A (0.34) HTR2AHTR2CFPR1FPR2HTR6
SCHEMBL6646243 0.90 HTR2C (0.37) HTR2AHTR2CHTR6SLC6A2SLC6A4
SCHEMBL6643396 0.90 HTR2C (0.37) HTR2AHTR2CHTR6SLC6A2SLC6A4
SCHEMBL6668438 0.88 SLC6A2 (0.37) HTR2AHTR2CHTR6SLC6A2SLC6A4
SCHEMBL6647053 0.88 HTR2C (0.35) HTR2AHTR2CHTR6SLC6A2SLC6A4
SCHEMBL6647620 0.88 HTR2C (0.35) HTR2AHTR2CHTR6SLC6A2SLC6A4
SCHEMBL6670628 0.88 SLC6A2 (0.37) HTR2AHTR2CHTR6SLC6A2SLC6A4
SCHEMBL6672161 0.86 HTR2C (0.33) HTR2AHTR2CHTR6SLC6A2SLC6A4
SCHEMBL6668293 0.86 HTR2C (0.33) HTR2AHTR2CHTR6SLC6A2SLC6A4
SCHEMBL6667998 0.86 HTR2C (0.32) HTR2CHTR2B

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 7 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
US-20030050304-A1 Therapeutic compounds PHARMACIA & UPJOHN COMPANY 2003-03-13 US 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 HTR2A 23/4885HTR2C 14/4885FPR1 79/4885
US-20030050304-A1 Therapeutic compounds HTR5A, HTR6, HTR1A HTR2A 23/4885HTR2C 14/4885FPR1 79/4885

“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.