SCHEMBL8575159

SCHEMBL8575159

c1nncc2c1cc1n2CCCC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 3/20 0.33
▸ HTR2C P28335 3/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ GRM5 P41594 1/20 0.32

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
SCHEMBL18527316 0.77 HTR2A (0.37) HTR2AHTR2CMEN1KMT2AGRM5
SCHEMBL18527166 0.77 HTR2A (0.37) HTR2AHTR2CMEN1KMT2AGRM5
SCHEMBL29548539 0.72 HTR2A (0.62) HTR2AHTR2C
SCHEMBL669577 0.72 HTR2A (0.62) HTR2AHTR2C
SCHEMBL6025331 0.71 HTR2A (0.38) HTR2AHTR2C
SCHEMBL6024522 0.71 HTR2A (0.38) HTR2AHTR2C
SCHEMBL7300514 0.70 HTR2A (0.60) HTR2AHTR2C
SCHEMBL18911620 0.70 HTR2A (0.60) HTR2AHTR2C
SCHEMBL30785316 0.68 GRM5 (0.36) MEN1KMT2AGRM5
SCHEMBL24916793 0.68 SIGMAR1 (0.50) HTR2AHTR2CMEN1KMT2A

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-5756501-A USEFUL FOR TREATING ALZHIMER'S DISEASE, DOWN'S SYNDROM AND PARKINSON'S DISEASE INVOLVING HYPOFUNCTION OF ACETYLCHOLINE IN MAMMAL AMERICAN HOME PRODUCTS CORPORATION (US) 1998-05-26 — — US disclosed
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