SCHEMBL6490201

SCHEMBL6490201

FC(F)(F)c1cccc(Nc2cc3c4c(c2)[C@@H]2CNCC[C@@H]2N4CCOC3)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDH2 P48735 4/20 0.41
HTR2C P28335 4/20 0.39
HTR2A P28223 3/20 0.39
HTR2B P41595 3/20 0.39
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
APP P05067 1/20 0.36
TRPV4 Q9HBA0 1/20 0.36
KIF11 P52732 6/20 0.36
CYP11B2 P19099 1/20 0.34

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
SCHEMBL6503618 0.92 HTR2C (0.40) IDH2HTR2CHTR2AHTR2B
SCHEMBL6782802 0.90 HTR2C (0.41) HTR2CHTR2AHTR2BKIF11
SCHEMBL6503399 0.89 HTR2C (0.38) HTR2CHTR2AHTR2B
SCHEMBL6491699 0.87 HTR2C (0.39) HTR2CHTR2AHTR2BSMN1; SMN2
SCHEMBL6503694 0.86 HTR2C (0.38) HTR2CHTR2AHTR2B
SCHEMBL6783539 0.86 HTR2C (0.39) HTR2CHTR2AHTR2B
SCHEMBL6784293 0.85 HTR2C (0.38) HTR2CHTR2AHTR2B
SCHEMBL6782654 0.85 HTR2C (0.42) HTR2CHTR2AHTR2B
SCHEMBL6499928 0.84 HTR2C (0.41) HTR2CHTR2AHTR2BUSP2
SCHEMBL6783931 0.84 HTR2C (0.42) 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 IDH2 4499/4885HTR2C 11/4885HTR2A 21/4885
US-20040186094-A1 Substituted pyridoindoles as serotonin agonists and antagonists HTR1A, HTR1B, HTR7 IDH2 4499/4885HTR2C 11/4885HTR2A 21/4885

“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.