SCHEMBL7219902

SCHEMBL7219902

CC(=O)Nc1ccc2c(c1)CCC2CN1CC=C(c2c[nH]c3cc(Cl)ccc23)CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 3/20 0.52
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42
DRD2 P14416 7/20 0.42
SLC6A4 P31645 7/20 0.42
ADRA1D P25100 1/20 0.42
HTR1B P28222 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
HTR1A P08908 6/20 0.41
HTR7 P34969 6/20 0.41
HTR6 P50406 6/20 0.41
HTR1F P30939 1/20 0.41

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
SCHEMBL6796026 0.94 HTR1D (0.48) HTR1DMAPTLMNAOPRM1OPRK1
SCHEMBL7705774 0.88 HTR1D (0.55) HTR1DLMNAOPRM1OPRK1DRD2
SCHEMBL6796662 0.88 OPRM1 (0.50) OPRM1OPRK1DRD2SLC6A4HTR1A
SCHEMBL6910708 0.86 HTR1D (0.47) HTR1DMAPTLMNAOPRM1OPRK1
SCHEMBL7219879 0.86 HTR1D (0.54) HTR1DMAPTLMNADRD2SLC6A4
SCHEMBL7220164 0.86 HTR1D (0.48) HTR1DMAPTLMNAOPRM1OPRK1
SCHEMBL7220690 0.85 HTR1D (0.49) HTR1DMAPTOPRM1OPRK1DRD2
SCHEMBL7213738 0.85 HTR1D (0.51) HTR1DDRD2SLC6A4HTR1AHTR7
Oxalic Acid SCHEMBL7214633 0.84 HTR1D (0.52) HTR1DMAPTLMNAOPRM1OPRK1
SCHEMBL7216019 0.84 HTR1D (0.51) HTR1DDRD2SLC6A4HTR1AHTR7

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 8 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
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 HTR1D 4/4885MAPT 2009/4885LMNA 4625/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 HTR1D 4/4885MAPT 2009/4885LMNA 4625/4885

“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.