SCHEMBL7220737

SCHEMBL7220737

CC(C)Oc1cccc2c1CCC2CN1CCC(c2c[nH]c3cc(Cl)ccc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.44
DRD2 P14416 2/20 0.44
OPRM1 P35372 3/20 0.43
OPRK1 P41145 3/20 0.43
OPRL1 P41146 3/20 0.43
ADRA1D P25100 4/20 0.41
HTR1A P08908 1/20 0.41
ADRA1B P35368 2/20 0.41
HTR2A P28223 1/20 0.40
HTR7 P34969 1/20 0.40
KCNH2 Q12809 1/20 0.40
SIGMAR1 Q99720 1/20 0.38
CTSS P25774 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL7220743 0.87 DRD2 (0.48) SLC6A4DRD2OPRM1OPRK1OPRL1
SCHEMBL7511636 0.84 OPRM1 (0.43) SLC6A4DRD2OPRM1OPRK1OPRL1
SCHEMBL7216044 0.83 OPRM1 (0.42) SLC6A4DRD2OPRM1OPRK1OPRL1
SCHEMBL7216381 0.83 HTR1A (0.46) SLC6A4DRD2OPRM1OPRK1HTR1A
Oxalic Acid SCHEMBL7216015 0.80 DRD2 (0.41) SLC6A4DRD2OPRM1OPRK1OPRL1
SCHEMBL7220832 0.79 OPRM1 (0.45) SLC6A4DRD2OPRM1OPRK1OPRL1
SCHEMBL7509027 0.78 APP (0.51) SLC6A4DRD2OPRM1OPRK1OPRL1
SCHEMBL7216053 0.74 SLC2A1 (0.47) SLC6A4DRD2OPRM1OPRK1OPRL1
SCHEMBL7213667 0.74 SLC2A1 (0.44) SLC6A4DRD2OPRM1OPRK1OPRL1
SCHEMBL6796369 0.73 OPRM1 (0.46) SLC6A4DRD2OPRM1OPRK1OPRL1

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 SLC6A4 40/4885DRD2 14/4885OPRM1 34/4885
US-20010021777-A1 Indane or dihydroindole derivatives HTR4, GPR4, GPR174 SLC6A4 40/4885DRD2 14/4885OPRM1 34/4885

“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.