SCHEMBL6589659

SCHEMBL6589659

CC1(C)Cc2cccc(C3=CCN(CCc4c[nH]c5cc(Cl)ccc45)CC3)c2O1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.45
HTR1A P08908 4/20 0.43
DRD2 P14416 4/20 0.43
SLC6A4 P31645 2/20 0.43
HTR7 P34969 2/20 0.43
HTR6 P50406 2/20 0.43

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
SCHEMBL6587179 0.85 HTR1D (0.49) HTR1DHTR1ADRD2SLC6A4
SCHEMBL6591284 0.81 DRD2 (0.59) HTR1ADRD2SLC6A4
SCHEMBL6590553 0.81 DRD2 (0.60) HTR1DHTR1ADRD2SLC6A4HTR7
Oxalic Acid SCHEMBL6776147 0.81 HTR1D (0.51) HTR1DHTR1ADRD2
SCHEMBL6592028 0.80 KCNH2 (0.47) HTR1ADRD2SLC6A4HTR7HTR6
SCHEMBL7538107 0.79 HTR1A (0.52) HTR1ADRD2SLC6A4
SCHEMBL6591122 0.78 HTR1A (0.47) HTR1ADRD2
Oxalic Acid SCHEMBL6773377 0.77 DRD2 (0.54) HTR1DHTR1ADRD2SLC6A4
Oxalic Acid SCHEMBL6773000 0.76 KCNH2 (0.48) HTR1ADRD2SLC6A4HTR7HTR6
Fumaric Acid SCHEMBL6593123 0.75 DRD2 (0.53) HTR1DHTR1ADRD2SLC6A4HTR7

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
EP-1007523-B9 INDOLE AND 2,3-DIHYDROINDOLE DERIVATIVES, THEIR PREPARATION AND USE LUNDBECK & CO AS H (DK) 2004-09-08 EP claimed
EP-1007523-B1 INDOLE AND 2,3-DIHYDROINDOLE DERIVATIVES, THEIR PREPARATION AND USE LUNDBECK & CO AS H (DK) 2003-10-22 EP claimed
US-6476035-B1 Indole and 2,3-dihydroindole derivatives, their preparation and use H. LUNDBECK A/S (DK) 2002-11-05 US claimed
EP-1007523-B9 INDOLE AND 2,3-DIHYDROINDOLE DERIVATIVES, THEIR PREPARATION AND USE LUNDBECK & CO AS H (DK) 2004-09-08 EP disclosed
US-6727263-B2 SEROTONINE REUPTAKE INHIBITOR; ANTIDEPRESSANTS; SIDE EFFECT REDUCTION H. LUNDBECK A/S (DK) 2004-04-27 US disclosed
EP-1007523-B1 INDOLE AND 2,3-DIHYDROINDOLE DERIVATIVES, THEIR PREPARATION AND USE LUNDBECK & CO AS H (DK) 2003-10-22 EP disclosed
US-20030018050-A1 Indole and 2,3-dihydroindole derivatives, their preparation and use H. LUNDBECK A/S (DK) 2003-01-23 US disclosed
US-6476035-B1 Indole and 2,3-dihydroindole derivatives, their preparation and use H. LUNDBECK A/S (DK) 2002-11-05 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 (1 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-20030018050-A1 Indole and 2,3-dihydroindole derivatives, their preparation and use TPH1, HTR1A, HTR3A HTR1D 9/4885HTR1A 2/4885DRD2 26/4885

“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.