SCHEMBL7213743

SCHEMBL7213743

Clc1ccc2c(C3=CCN(CCCCN4CCc5ccccc54)CC3)c[nH]c2c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.57
OPRM1 P35372 1/20 0.53
OPRK1 P41145 1/20 0.53
HTR1A P08908 6/20 0.51
SLC6A4 P31645 6/20 0.51
HTR7 P34969 6/20 0.51
HTR6 P50406 6/20 0.51
SIGMAR1 Q99720 1/20 0.50
HTR1D P28221 1/20 0.49

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
SCHEMBL7214501 0.98 DRD2 (0.55) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7220193 0.94 OPRM1 (0.55) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7220857 0.84 DRD2 (0.53) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7213683 0.83 DRD2 (0.57) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7214300 0.82 DRD2 (0.56) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7213892 0.82 HTR1D (0.52) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7214030 0.80 DRD2 (0.54) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7214469 0.80 HTR1D (0.57) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7668732 0.80 DRD2 (0.56) DRD2OPRM1OPRK1HTR1ASLC6A4
SCHEMBL7220408 0.79 DRD2 (0.53) DRD2OPRM1OPRK1HTR1ASLC6A4

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 DRD2 14/4885OPRM1 34/4885OPRK1 23/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 DRD2 14/4885OPRM1 34/4885OPRK1 23/4885

“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.