SCHEMBL5755013

SCHEMBL5755013

Fc1ccc(C2CCN(Cc3ccc4cc[nH]c4c3)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.50
KCNH2 Q12809 2/20 0.50
MCHR2 Q969V1 2/20 0.50
SSTR5 P35346 1/20 0.49
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46
AHR P35869 1/20 0.45
FAAH O00519 1/20 0.45
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
SLC18A3 Q16572 2/20 0.43
CCR3 P51677 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
TYK2 P29597 1/20 0.43
JAK3 P52333 1/20 0.43
SLC6A2 P23975 1/20 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
SCHEMBL5753239 0.91 SSTR5 (0.58) MCHR1KCNH2MCHR2SSTR5BCHE
SCHEMBL5753083 0.88 DRD2 (0.53) MCHR1KCNH2MCHR2ACHEFAAH
SCHEMBL10556550 0.81 MEN1 (0.61) BCHEACHEDRD2SLC18A3SIGMAR1
SCHEMBL7078098 0.80 MAPT (0.57) MCHR1KCNH2MCHR2SSTR5DRD2
SCHEMBL5752080 0.79 MEN1 (0.58) MCHR1SSTR5ACHEAHRFAAH
SCHEMBL5751430 0.79 DRD4 (0.52) MCHR1KCNH2MCHR2SSTR5ACHE
SCHEMBL14375335 0.79 ACHE (0.62) MCHR1KCNH2MCHR2ACHEFAAH
SCHEMBL18926970 0.75 HRH3 (0.55) FAAH
SCHEMBL30678678 0.74 FAAH (0.58) MCHR1KCNH2MCHR2ACHEFAAH
SCHEMBL29869413 0.74 MEN1 (0.54) MCHR1BCHEACHEDRD2DRD4

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105543-B2 4-, 5-, 6- and 7-indole derivatives useful for the treatment of CNS disorders H. LUNDBECK A/S (DK) 2006-09-12 US claimed
EP-1309586-B1 4-, 5-, 6- AND 7-INDOLE DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS LUNDBECK & CO AS H (DK) 2006-03-22 EP claimed
US-7105543-B2 4-, 5-, 6- and 7-indole derivatives useful for the treatment of CNS disorders H. LUNDBECK A/S (DK) 2006-09-12 US disclosed
EP-1309586-B1 4-, 5-, 6- AND 7-INDOLE DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS LUNDBECK & CO AS H (DK) 2006-03-22 EP disclosed
US-20060004022-A1 4-, 5-, 6- And 7-indole derivatives useful for the treatment of CNS disorders H. LUNDBECK A/S (DK) 2006-01-05 US disclosed
US-6958338-B2 4-,5-,6-and 7-indole derivatives useful for the treatment of CNS disorders H. LUNDBECK A/S (DK) 2005-10-25 US disclosed
US-20030166665-A1 4-,5-,6-And 7-indole derivatives useful for the treatment of CNS disorders H. LUNDBECK A/S (DK) 2003-09-04 US disclosed
EP-1309586-A1 4-, 5-, 6- AND 7-INDOLE DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS H. LUNDBECK A/S (DK) 2003-05-14 EP disclosed
WO-2002016349-A1 4-, 5-, 6- AND 7-INDOLE DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS H. LUNDBECK A/S (DK) 2002-02-28 WO 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-20060004022-A1 4-, 5-, 6- And 7-indole derivatives useful for the treatment of CNS disorders HTR3C, SLC6A3, HTR6 MCHR1 95/4885KCNH2 319/4885MCHR2 174/4885
US-20030166665-A1 4-,5-,6-And 7-indole derivatives useful for the treatment of CNS disorders HTR3C, HTR6, SLC6A3 MCHR1 92/4885KCNH2 215/4885MCHR2 191/4885

“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.