SCHEMBL7214623

SCHEMBL7214623

c1ccc2c(c1)CC(CCN1CCC(c3cc4ccccc4[nH]3)CC1)C2

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.50
ADRA1B P35368 1/20 0.50
CHRNA7 P36544 3/20 0.49
HRH3 Q9Y5N1 4/20 0.41
HRH4 Q9H3N8 2/20 0.40
VCP P55072 1/20 0.40
DRD2 P14416 4/20 0.40
HTR1A P08908 3/20 0.40
DRD3 P35462 3/20 0.40
SLC6A4 P31645 3/20 0.40
HTR2A P28223 2/20 0.40
HTR2B P41595 1/20 0.40
SLC6A2 P23975 1/20 0.38
AKR1C3 P42330 1/20 0.37
DRD4 P21917 1/20 0.37
HTR2C P28335 1/20 0.37

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
SCHEMBL7219760 0.88 SIGMAR1 (0.49) HTR7ADRA1BCHRNA7HRH3HRH4
SCHEMBL7221068 0.88 DRD2 (0.45) HTR7ADRA1BCHRNA7HRH3HRH4
SCHEMBL7203954 0.79 HRH4 (0.53) HTR7ADRA1BCHRNA7HRH3HRH4
SCHEMBL7533009 0.79 CHRNA7 (0.52) HTR7ADRA1BCHRNA7HRH3HRH4
SCHEMBL27502681 0.78 GRIN2B (0.54) HTR7ADRA1BCHRNA7HRH3HRH4
SCHEMBL7213814 0.75 OPRM1 (0.44) HRH3HRH4DRD2HTR1ADRD3
SCHEMBL73543 0.73 AOC3 (0.47) CHRNA7SLC6A4
SCHEMBL7214674 0.72 DRD2 (0.42) HTR7HRH3HRH4VCPDRD2
SCHEMBL8871601 0.71 HTR1A (0.64) HTR7DRD2HTR1ADRD3SLC6A4
SCHEMBL7216011 0.71 DRD2 (0.50) HTR7ADRA1BCHRNA7DRD2HTR1A

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 7 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
CN-1246117-A 1, 2-indane or indoline derivatives LUNDBECK & CO AS H (DK) 2000-03-01 CN 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 HTR7 79/4885ADRA1B 64/4885CHRNA7 222/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 HTR7 79/4885ADRA1B 64/4885CHRNA7 222/4885

“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.