SCHEMBL7213673

SCHEMBL7213673

CCCOc1ccc2c(c1)CC(CN1CCC(c3c[nH]c4cc(Cl)ccc34)CC1)C2

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.51
DRD2 P14416 4/20 0.45
SLC6A4 P31645 2/20 0.45
HTR2A P28223 3/20 0.44
HTR1A P08908 2/20 0.43
DRD1 P21728 2/20 0.43
HTR2C P28335 2/20 0.43
DRD3 P35462 2/20 0.43
HTR6 P50406 2/20 0.43
OPRM1 P35372 4/20 0.42
OPRK1 P41145 4/20 0.42
OPRL1 P41146 4/20 0.42
ADRA1D P25100 2/20 0.38
APP P05067 2/20 0.37
IDO1 P14902 1/20 0.37
OPRD1 P41143 1/20 0.36
MCHR1 Q99705 1/20 0.36

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
SCHEMBL7213667 0.87 SLC2A1 (0.44) SLC2A1DRD2SLC6A4HTR2AHTR1A
SCHEMBL7216053 0.85 SLC2A1 (0.47) SLC2A1DRD2SLC6A4HTR2AHTR1A
SCHEMBL7511639 0.84 DRD2 (0.45) SLC2A1DRD2SLC6A4HTR2AHTR1A
SCHEMBL7216028 0.83 OPRM1 (0.56) SLC2A1DRD2SLC6A4HTR2AHTR1A
SCHEMBL7213713 0.82 APP (0.51) DRD2SLC6A4HTR2AHTR1ADRD1
SCHEMBL7214617 0.80 DRD2 (0.46) DRD2SLC6A4HTR2AHTR1AHTR6
SCHEMBL7220850 0.78 HTR1D (0.54) DRD2HTR2AHTR1ADRD1HTR2C
Oxalic Acid SCHEMBL7215994 0.78 OPRM1 (0.53) DRD2SLC6A4HTR2AHTR1ADRD1
SCHEMBL7511636 0.74 OPRM1 (0.43) SLC2A1DRD2SLC6A4HTR2AHTR1A
SCHEMBL7220743 0.74 DRD2 (0.48) SLC2A1DRD2SLC6A4HTR2AHTR1A

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-6552044-B2 Dopamine receptors H. LUNDBECK A/S (DK) 2003-04-22 US disclosed
EP-0946542-B1 INDANE OR DIHYDROINDOLE DERIVATIVES LUNDBECK & CO AS H (DK) 2002-10-09 EP disclosed
US-6352988-B2 HIGH AFFINITY FOR D4 RECEPTORS; TREATMENT OF SCHIZOPHRENIA, OTHER PSYCHOSES, ANXIETY DISORDERS, DEPRESSION, ALCOHOL ABUSE, IMPULSE CONTROL DISORDERS, AGGRESSION H. LUNDBECK A/S (DK) 2002-03-05 US disclosed
US-20010021777-A1 Indane or dihydroindole derivatives H. LUNDBECK A/S (DK) 2001-09-13 US disclosed
US-20010020095-A1 Indane or dihydroindole derivatives H. LUNDBECK A/S (DK) 2001-09-06 US disclosed
US-6262087-B1 HAVE HIGH AFFINITY FOR D4 RECEPTORS; USEFUL IN THE TREATMENT OF CERTAIN PSYCHIATRIC AND NEUROLOGIC DISORDERS, INCLUDING PSYCHOSIS, DEPRESSION AND ANXIETY. H. LUNDBECK A/S (DK) 2001-07-17 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-20010020095-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 SLC2A1 1917/4885DRD2 14/4885SLC6A4 40/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 SLC2A1 1917/4885DRD2 14/4885SLC6A4 40/4885

“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.