SCHEMBL6785282

SCHEMBL6785282

Fc1cc(F)cc(-c2cccc3c2[C@@H]2CCNCC[C@@H]2N3)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 3/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
HTR1A P08908 3/20 0.34
HTR7 P34969 1/20 0.34
SLC6A2 P23975 3/20 0.32
SLC6A4 P31645 3/20 0.32
SLC6A3 Q01959 3/20 0.32
F10 P00742 1/20 0.31
PLAT P00750 1/20 0.31
DRD2 P14416 1/20 0.31
HTR2A P28223 1/20 0.31
KCNH2 Q12809 1/20 0.31
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
HTR6 P50406 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
SCHEMBL6785280 1.00 CHRM3 (0.35) CHRM3LMNATSHRHTR1AHTR7
SCHEMBL6782257 0.91 PLAT (0.39) CHRM3LMNATSHRHTR1AHTR7
SCHEMBL6782255 0.91 PLAT (0.39) CHRM3LMNATSHRHTR1AHTR7
SCHEMBL6785604 0.88 HTR7 (0.40) CHRM3LMNATSHRHTR1AHTR7
SCHEMBL6785602 0.88 HTR7 (0.40) CHRM3LMNATSHRHTR1AHTR7
SCHEMBL6785254 0.85 CREBBP (0.42) CHRM3LMNATSHRDRD2HTR2A
SCHEMBL6785250 0.85 CREBBP (0.42) CHRM3LMNATSHRDRD2HTR2A
SCHEMBL6786914 0.84 CHRM1 (0.37) CHRM3LMNATSHRHTR1AHTR7
SCHEMBL6786259 0.84 BRD4 (0.41) LMNATSHR
SCHEMBL6786256 0.84 BRD4 (0.41) LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6828314-B2 Modulation of the activity of serotonin receptors (5-HT) to treat diseases such as anxiety, depression or obesity PFIZER 2004-12-07 US disclosed
US-20030225058-A1 Substituted azepino[4,5b]indoline derivatives PHARMACIA & UPJOHN COMPANY 2003-12-04 US disclosed
US-6586421-B2 For therapy of central nervous system, including diseases, disorders, and conditions related to, such as anxiety, depression, hypertension, migraine, obesity, compulsive disorders, schizophrenia, autism, neurodegenerative disorders PHARMACIA & UPJOHN COMPANY 2003-07-01 US disclosed
US-20020077318-A1 Substituted azepino[4,5b] indoline derivatives PHARMACIA & UPJOHN COMPANY 2002-06-20 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 (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-20030225058-A1 Substituted azepino[4,5b]indoline derivatives HTR5A, HTR1A, HTR4 CHRM3 294/4885LMNA 4136/4885TSHR 134/4885
US-20020077318-A1 Substituted azepino[4,5b] indoline derivatives HTR5A, HTR1A, HTR4 CHRM3 294/4885LMNA 4136/4885TSHR 134/4885

“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.