SCHEMBL8984359

SCHEMBL8984359

CN1CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 20/20 1.00
HTR1B P28222 20/20 1.00

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
SCHEMBL8984430 0.97 HTR1D (1.00) HTR1DHTR1B
SCHEMBL8984412 0.93 HTR1D (1.00) HTR1DHTR1B
SCHEMBL8923743 0.90 HTR1D (0.82) HTR1DHTR1B
SCHEMBL7474899 0.89 HTR1D (0.88) HTR1DHTR1B
SCHEMBL8151636 0.89 HTR1D (1.00) HTR1DHTR1B
SCHEMBL7476126 0.87 HTR1D (0.77) HTR1DHTR1B
SCHEMBL7478991 0.87 HTR1D (0.77) HTR1DHTR1B
SCHEMBL8924018 0.87 HTR1D (0.77) HTR1DHTR1B
SCHEMBL7474121 0.87 HTR1D (0.77) HTR1DHTR1B
SCHEMBL7479048 0.87 HTR1D (1.00) HTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5552402-A Five-membered heteroaromatic compounds as 5-HT receptor agonists MERCK, SHARP & DOHME LTD. (GB) 1996-09-03 US disclosed