SCHEMBL16518260

SCHEMBL16518260

NC(N)=NC(=O)N1CCc2cccc(-c3ccccc3)c2C1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR5A P47898 14/20 0.68
▸ ABHD6 Q9BV23 1/20 0.45
▸ UCHL1 P09936 1/20 0.43
▸ ANPEP P15144 1/20 0.40
▸ IL1RN P18510 1/20 0.40
▸ ERAP2 Q6P179 1/20 0.40
▸ ERAP1 Q9NZ08 1/20 0.40
▸ HTR7 P34969 1/20 0.40
▸ HTR2B P41595 1/20 0.40

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
SCHEMBL16518262 0.89 HTR5A (0.71) HTR5A
SCHEMBL16518251 0.85 HTR5A (0.69) HTR5AHTR7HTR2B
SCHEMBL16518267 0.83 HTR5A (0.76) HTR5A
SCHEMBL16518258 0.82 HTR5A (0.67) HTR5A
SCHEMBL16518254 0.82 HTR5A (0.78) HTR5A
SCHEMBL16518255 0.81 HTR5A (1.00) HTR5A
SCHEMBL16518309 0.81 HTR5A (0.59) HTR5AABHD6
SCHEMBL11495251 0.80 NOTUM (0.60) HTR5AABHD6UCHL1
SCHEMBL16518250 0.80 HTR5A (0.74) HTR5A
SCHEMBL16518271 0.79 HTR5A (0.70) HTR5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962612-B2 Tetrahydroisoquinoline derivative ASTELLAS PHARMA INC. (JP) 2015-02-24 — — US disclosed
US-8962612-B2 Tetrahydroisoquinoline derivative ASTELLAS PHARMA INC. (JP) 2015-02-24 — — US disclosed
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