SCHEMBL7214715

SCHEMBL7214715

N#Cc1ccc2c(c1)C(CN1CCC(c3c[nH]c4cc(Cl)ccc34)CC1)CC2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
OPRK1 P41145 1/20 0.44
OPRL1 P41146 1/20 0.44
SLC6A4 P31645 8/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A3 Q01959 2/20 0.41
DRD2 P14416 2/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
GABRA4 P48169 1/20 0.40
GABRE P78334 1/20 0.40
GABRA6 Q16445 1/20 0.40

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
SCHEMBL6796369 0.86 OPRM1 (0.46) OPRM1OPRK1OPRL1SLC6A4DRD2
SCHEMBL7219366 0.81 HTR1D (0.46) OPRM1OPRK1SLC6A4DRD2
SCHEMBL7509027 0.80 APP (0.51) OPRM1OPRK1OPRL1SLC6A4DRD2
SCHEMBL6795501 0.80 HTR1D (0.53)
Oxalic Acid SCHEMBL6801356 0.78 HTR1D (0.51) OPRM1OPRK1OPRL1
SCHEMBL7216044 0.76 OPRM1 (0.42) OPRM1OPRK1OPRL1SLC6A4DRD2
SCHEMBL7216053 0.75 SLC2A1 (0.47) OPRM1OPRK1OPRL1SLC6A4DRD2
SCHEMBL7220832 0.75 OPRM1 (0.45) OPRM1OPRK1OPRL1SLC6A4DRD2
SCHEMBL7216028 0.73 OPRM1 (0.56) OPRM1OPRK1OPRL1SLC6A4DRD2
SCHEMBL7214646 0.73 ADRA1D (0.54) OPRM1OPRK1OPRL1SLC6A4ADRA1D

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 OPRM1 34/4885OPRK1 23/4885OPRL1 20/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 OPRM1 34/4885OPRK1 23/4885OPRL1 20/4885

“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.