SCHEMBL7213738

SCHEMBL7213738

CC(=O)Nc1ccc2c(c1)C(CCCN1CC=C(c3c[nH]c4cc(Cl)ccc34)CC1)CC2

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.51
DRD2 P14416 12/20 0.45
HTR1A P08908 11/20 0.45
SLC6A4 P31645 11/20 0.45
HTR7 P34969 11/20 0.45
HTR6 P50406 11/20 0.45
MTNR1A P48039 1/20 0.45

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
Oxalic Acid SCHEMBL7220017 0.98 HTR1D (0.49) HTR1DDRD2HTR1ASLC6A4HTR7
SCHEMBL7216019 0.98 HTR1D (0.51) HTR1DDRD2HTR1ASLC6A4HTR7
Oxalic Acid SCHEMBL7219944 0.96 HTR1D (0.49) HTR1DDRD2HTR1ASLC6A4HTR7
SCHEMBL7219879 0.95 HTR1D (0.54) HTR1DDRD2HTR1ASLC6A4HTR7
Oxalic Acid SCHEMBL7214633 0.93 HTR1D (0.52) HTR1DDRD2HTR1ASLC6A4HTR7
SCHEMBL6796026 0.91 HTR1D (0.48) HTR1DDRD2HTR1ASLC6A4HTR7
SCHEMBL7219902 0.85 HTR1D (0.52) HTR1DDRD2HTR1ASLC6A4HTR7
SCHEMBL6796662 0.85 OPRM1 (0.50) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL6910708 0.84 HTR1D (0.47) HTR1DDRD2HTR1ASLC6A4HTR7
SCHEMBL7220408 0.83 DRD2 (0.53) HTR1DDRD2HTR1ASLC6A4HTR7

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 HTR1D 4/4885DRD2 14/4885HTR1A 5/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 HTR1D 4/4885DRD2 14/4885HTR1A 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.