SCHEMBL4870640

SCHEMBL4870640

COc1cc2ncn(CCN3CC=C(c4c[nH]c5ccccc45)CC3)c(=O)c2cc1OC.[N]

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.54
SLC6A4 P31645 2/20 0.54
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
ALOX15 P16050 1/20 0.51
DRD2 P14416 5/20 0.51
HTR2A P28223 2/20 0.51
DRD1 P21728 1/20 0.49
DRD3 P35462 1/20 0.49

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
SCHEMBL4868630 0.99 HTR1A (0.55) HTR1ASLC6A4KDM4ELMNAALOX15
SCHEMBL4872140 0.94 DRD2 (0.54) HTR1ASLC6A4KDM4ELMNAALOX15
SCHEMBL4873344 0.94 DRD2 (0.56) HTR1ASLC6A4KDM4ELMNAALOX15
SCHEMBL4869010 0.90 HTR1A (0.55) HTR1ASLC6A4DRD2HTR2ADRD3
SCHEMBL4867310 0.86 HTR1A (0.62) HTR1ASLC6A4KDM4ELMNAALOX15
SCHEMBL4872356 0.86 DRD2 (0.58) HTR1ASLC6A4DRD2HTR2ADRD3
SCHEMBL4865544 0.84 DRD2 (0.59) HTR1ASLC6A4KDM4ELMNAALOX15
SCHEMBL4862051 0.79 DRD2 (0.59) HTR1ASLC6A4DRD2
SCHEMBL4872113 0.78 ADRA1A (0.55) HTR1ASLC6A4DRD2HTR2A
SCHEMBL4872709 0.76 TNF (0.43) HTR1ADRD2DRD3

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-7332506-B2 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression WYETH (US) 2008-02-19 US disclosed
US-20070049582-A1 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression WYETH (US) 2007-03-01 US disclosed
US-7148235-B2 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression WYETH (US) 2006-12-12 US disclosed
US-20050239775-A1 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression WYETH (US) 2005-10-27 US disclosed
US-6939870-B2 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression WYETH (US) 2005-09-06 US disclosed
US-20040204402-A1 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression WYETH 2004-10-14 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 (3 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-20040204402-A1 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression TPH1, TPH2, HTR1A HTR1A 3/4885SLC6A4 21/4885KDM4E 1002/4885
US-20050239775-A1 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression TPH1, TPH2, HTR1A HTR1A 3/4885SLC6A4 20/4885KDM4E 827/4885
US-20070049582-A1 Substituted-3-indolyl-4-piperidino-alkyl heterocycles for the treatment of depression TPH1, TPH2, HTR1A HTR1A 3/4885SLC6A4 20/4885KDM4E 827/4885

“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.