SCHEMBL7554470

SCHEMBL7554470

CCc1ccc(CN2CCN(CC(=O)N3c4ccccc4C[C@H]3CO)CC2)cc1

nearest known ligand 0.82

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 19/20 0.82
DRD4 P21917 19/20 0.82
ADRA1D P25100 2/20 0.67
ADRA1A P35348 2/20 0.67
ADRA1B P35368 2/20 0.67
SLC6A4 P31645 1/20 0.67
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65

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
SCHEMBL7553950 0.91 DRD2 (0.84) DRD2DRD4ADRA1DADRA1AADRA1B
SCHEMBL7552536 0.90 DRD4 (1.00) DRD2DRD4ADRA1DADRA1AADRA1B
SCHEMBL7557175 0.89 DRD2 (0.81) DRD2DRD4ADRA1DADRA1AADRA1B
SCHEMBL12676326 0.81 MEN1 (0.95) DRD2DRD4ADRA1DADRA1AADRA1B
SCHEMBL7551711 0.80 DRD2 (0.79) DRD2DRD4ADRA1DADRA1AADRA1B
SCHEMBL7552007 0.80 DRD4 (0.79) DRD2DRD4
SCHEMBL7551417 0.80 DRD2 (0.79) DRD2DRD4ADRA1DADRA1AADRA1B
SCHEMBL7552038 0.80 DRD4 (0.79) DRD2DRD4ADRA1DADRA1AADRA1B
SCHEMBL7654394 0.80 DRD2 (1.00) DRD2DRD4ADRA1DADRA1AADRA1B
SCHEMBL7665453 0.80 DRD2 (1.00) DRD2DRD4ADRA1DADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128274-A1 Benzylpiperazinyl-indolinylethanones NEUROGEN CORPORATION. 2002-09-12 US claimed
US-6355644-B1 NERVOUS SYSTEM DISORDERS AND TREATMENT OF SCHIZOPHRENIA AND BIPOLAR DISORDER NEUROGEN CORPORATION 2002-03-12 US claimed
WO-2000076967-A1 BENZYLPIPERAZINYL-INDOLINYLETHANONES NEUROGEN CORPORATION (US) 2000-12-21 WO claimed

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-20020128274-A1 Benzylpiperazinyl-indolinylethanones GABRP, GABBR1, GABARAP DRD2 30/4885DRD4 57/4885ADRA1D 232/4885

“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.