SCHEMBL4849753

SCHEMBL4849753

CCCCn1cc(C2CCN(C=CC(=O)c3ccccc3Cl)C2)c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 4/20 0.52
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
CNR2 P34972 9/20 0.45
CNR1 P21554 6/20 0.45
DRD2 P14416 1/20 0.40
HTR6 P50406 1/20 0.40

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
SCHEMBL4849757 0.78 HRH2 (0.47) HRH2HTR2AHTR2CHTR2BCNR2
SCHEMBL5799049 0.75 HRH2 (0.44) HRH2HTR2AHTR2CHTR2BCNR2
SCHEMBL5204952 0.75 HRH2 (0.55) HRH2HTR2AHTR2CHTR2BCNR2
SCHEMBL5203433 0.74 TPSAB1 (0.50) HRH2HTR2AHTR2CHTR2BCNR2
SCHEMBL5202233 0.73 HRH2 (0.41) HRH2HTR2AHTR2CHTR2B
SCHEMBL4858049 0.72 MEN1 (0.52) HTR2AHTR2CHTR6
SCHEMBL5205873 0.71 HRH2 (0.51) HRH2HTR2AHTR2CHTR2BCNR2
SCHEMBL27559062 0.70 HRH2 (0.59) HRH2HTR2AHTR2CHTR2BCNR2
SCHEMBL5205803 0.70 HRH2 (0.50) HRH2HTR2AHTR2CHTR2BCNR2
SCHEMBL6781923 0.69 HRH2 (1.00) HRH2HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7368470-B2 Substituted 3-pyrrolidine-indole derivatives GRUENENTHAL GMBH (DE) 2008-05-06 US claimed
EP-1654253-B1 SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES GRUENENTHAL GMBH (DE) 2007-01-03 EP claimed
US-20050096376-A1 Substituted 3-pyrrolidine-indole derivatives GRUENENTHAL GMBH (DE) 2005-05-05 US claimed
US-7368470-B2 Substituted 3-pyrrolidine-indole derivatives GRUENENTHAL GMBH (DE) 2008-05-06 US disclosed
EP-1654253-B1 SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES GRUENENTHAL GMBH (DE) 2007-01-03 EP disclosed
US-20050096376-A1 Substituted 3-pyrrolidine-indole derivatives GRUENENTHAL GMBH (DE) 2005-05-05 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 (1 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-20050096376-A1 Substituted 3-pyrrolidine-indole derivatives OPRD1, OPRK1, TPH1 HRH2 973/4885HTR2A 12/4885HTR2C 7/4885

“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.