SCHEMBL7214372

SCHEMBL7214372

Fc1ccc2[nH]cc(C3CCN(CCCCC4CCc5ccccc54)CC3)c2c1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 3/20 0.58
ADRA1B P35368 1/20 0.58
HTR1A P08908 7/20 0.57
SLC6A4 P31645 6/20 0.57
HTR7 P34969 5/20 0.57
DRD2 P14416 3/20 0.57
HTR2A P28223 3/20 0.57
HTR6 P50406 3/20 0.57
OPRM1 P35372 2/20 0.54
OPRK1 P41145 2/20 0.54
OPRL1 P41146 2/20 0.54
KCNH2 Q12809 1/20 0.52

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
SCHEMBL7214486 0.93 OPRM1 (0.56) ADRA1DADRA1BHTR1ASLC6A4HTR7
SCHEMBL5396886 0.83 ADRA1D (0.82) ADRA1DADRA1BHTR1ASLC6A4HTR7
SCHEMBL7214646 0.83 ADRA1D (0.54) ADRA1DADRA1BSLC6A4OPRM1OPRK1
SCHEMBL5399785 0.82 ADRA1D (0.54) ADRA1DADRA1BHTR1ASLC6A4HTR7
SCHEMBL7215170 0.81 DRD2 (0.64) HTR1ASLC6A4HTR7DRD2HTR2A
SCHEMBL4839759 0.81 OPRM1 (0.54) ADRA1DADRA1BHTR1ASLC6A4HTR7
SCHEMBL4839772 0.81 OPRM1 (0.54) ADRA1DADRA1BHTR1ASLC6A4HTR7
SCHEMBL7214328 0.81 DRD2 (0.65) HTR1ASLC6A4HTR7DRD2HTR2A
SCHEMBL5389484 0.80 ADRA1D (0.58) ADRA1DADRA1BHTR1ASLC6A4HTR7
SCHEMBL5393529 0.80 ADRA1D (0.57) ADRA1DADRA1BHTR1ASLC6A4HTR7

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 9 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
EP-0946542-A1 INDANE OR DIHYDROINDOLE DERIVATIVES H. LUNDBECK A/S (DK) 1999-10-06 EP disclosed
WO-1998028293-A1 INDANE OR DIHYDROINDOLE DERIVATIVES H.LUNDBECK A/S (DK) 1998-07-02 WO 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 ADRA1D 22/4885ADRA1B 64/4885HTR1A 5/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 ADRA1D 22/4885ADRA1B 64/4885HTR1A 5/4885

“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.