SCHEMBL6491607

SCHEMBL6491607

CC(=O)c1cc(F)ccc1-c1cc2c3c(c1)[C@@H]1CNCC[C@@H]1N3CCSC2

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.46
HTR2A P28223 4/20 0.46
HTR2B P41595 2/20 0.46
HCRTR1 O43613 2/20 0.32
HCRTR2 O43614 2/20 0.32
CHRM1 P11229 1/20 0.31
KLKB1 P03952 2/20 0.31
DRD2 P14416 1/20 0.30
CHRM3 P20309 1/20 0.30
KCNH2 Q12809 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
SCHEMBL6493834 0.90 HTR2C (0.45) HTR2CHTR2AHTR2BCHRM1CHRM3
SCHEMBL6491276 0.88 HTR2C (0.57) HTR2CHTR2AHTR2B
SCHEMBL6492742 0.85 HTR2C (0.46) HTR2CHTR2AHTR2BHCRTR1HCRTR2
SCHEMBL6494215 0.85 HTR2C (0.46) HTR2CHTR2AHTR2B
SCHEMBL5637708 0.83 HTR2C (0.65) HTR2CHTR2AHTR2BDRD2
SCHEMBL6783978 0.78 HTR2C (0.67) HTR2CHTR2AHTR2BKCNH2
SCHEMBL6784796 0.78 HTR2C (0.52) HTR2CHTR2AHTR2B
SCHEMBL6499578 0.78 HTR2C (0.46) HTR2CHTR2AHTR2B
SCHEMBL6780922 0.77 HTR2C (0.65) HTR2CHTR2AHTR2B
SCHEMBL6783098 0.77 HTR2C (0.44) HTR2CHTR2AHTR2B

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-6849619-B2 Substituted pyridoindoles as serotonin agonists and antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2005-02-01 US disclosed
US-20040186094-A1 Substituted pyridoindoles as serotonin agonists and antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-09-23 US disclosed
US-6699852-B2 ANTISEROTONIN AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS; ANTIDEPRESSANTS BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-03-02 US disclosed
US-20020173503-A1 Substituted pyridoindoles as serotonin agonists and antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-11-21 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-20020173503-A1 Substituted pyridoindoles as serotonin agonists and antagonists HTR1A, HTR1B, HTR7 HTR2C 11/4885HTR2A 21/4885HTR2B 5/4885
US-20040186094-A1 Substituted pyridoindoles as serotonin agonists and antagonists HTR1A, HTR1B, HTR7 HTR2C 11/4885HTR2A 21/4885HTR2B 5/4885

“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.