SCHEMBL7835876

SCHEMBL7835876

c1ccc2c(OCCNCCCc3c[nH]c4ccccc34)cccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 16/20 1.00
SLC6A4 P31645 11/20 1.00
KMT2A Q03164 1/20 0.58
HTR1B P28222 2/20 0.55
HTR1D P28221 1/20 0.55

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
SCHEMBL7843688 1.00 HTR1A (1.00) HTR1ASLC6A4KMT2AHTR1BHTR1D
SCHEMBL7846504 0.89 HTR1A (1.00) HTR1ASLC6A4HTR1B
SCHEMBL16540680 0.89 HTR1A (0.79) HTR1ASLC6A4HTR1BHTR1D
SCHEMBL7838153 0.87 HTR1A (1.00) HTR1ASLC6A4
SCHEMBL7833926 0.86 HTR1A (1.00) HTR1ASLC6A4
SCHEMBL7494997 0.85 HTR1A (0.74) HTR1ASLC6A4
Hydrochloric Acid SCHEMBL9272887 0.85 HTR1A (0.81) HTR1ASLC6A4KMT2A
SCHEMBL7845074 0.83 HTR1A (0.74) HTR1ASLC6A4
SCHEMBL7498314 0.82 HTR1A (0.74) HTR1ASLC6A4
SCHEMBL7498877 0.82 HTR1A (0.72) HTR1ASLC6A4

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-6291683-B1 AS ANTIDEPRESSANTS AMERICAN HOME PRODUCTS CORP 2001-09-18 US claimed
EP-1070050-A1 N-ARYLOXYETHYL-INDOLY-ALKYLAMINES FOR THE TREATMENT OF DEPRESSION (5-HT1A RECEPTOR ACTIVE AGENTS) AMERICAN HOME PRODUCTS CORPORATION (US) 2001-01-24 EP claimed
WO-1999051575-A1 N-ARYLOXYETHYL-INDOLY-ALKYLAMINES FOR THE TREATMENT OF DEPRESSION (5-HT1A RECEPTOR ACTIVE AGENTS) AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-14 WO claimed
US-6291683-B1 AS ANTIDEPRESSANTS AMERICAN HOME PRODUCTS CORP 2001-09-18 US disclosed
EP-1070050-A1 N-ARYLOXYETHYL-INDOLY-ALKYLAMINES FOR THE TREATMENT OF DEPRESSION (5-HT1A RECEPTOR ACTIVE AGENTS) AMERICAN HOME PRODUCTS CORPORATION (US) 2001-01-24 EP disclosed
US-6121307-A SIDE EFFECT REDUCTION; ADMINISTERING TO TREAT DEPRESSION AMERICAN HOME PRODUCTS CORP. (US) 2000-09-19 US disclosed
WO-1999051575-A1 N-ARYLOXYETHYL-INDOLY-ALKYLAMINES FOR THE TREATMENT OF DEPRESSION (5-HT1A RECEPTOR ACTIVE AGENTS) AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-14 WO disclosed