SCHEMBL5297611

SCHEMBL5297611

Clc1ccc(CC2CCCN2)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 10/20 0.46
▸ LTA4H P09960 2/20 0.46
▸ POLB P06746 1/20 0.42
▸ HTR2A P28223 2/20 0.42
▸ IDO1 P14902 1/20 0.42

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
SCHEMBL28265726 0.81 POLB (0.48) HTR6LTA4HPOLBHTR2A
SCHEMBL6796105 0.80 HTR6 (0.55) HTR6POLBHTR2A
SCHEMBL18019793 0.80 HTR6 (0.55) HTR6POLBHTR2A
SCHEMBL18019790 0.80 HTR6 (0.55) HTR6POLBHTR2A
SCHEMBL4282739 0.79 SLC6A4 (0.42) HTR2AIDO1
Hydrochloric Acid SCHEMBL17979687 0.79 HTR6 (0.56) HTR6POLBHTR2A
SCHEMBL27636075 0.79 HSD17B10 (0.44) HTR6
SCHEMBL12244120 0.78 HTR6 (0.68) HTR6HTR2A
SCHEMBL12244098 0.77 HTR6 (0.67) HTR6
SCHEMBL13809136 0.77 LTA4H (0.66) LTA4H

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
CN-108976227-A Benzothiazine -4- ketone compounds containing alkaline bridged ring segment and preparation method thereof 浙江司太立制药股份有限公司 2018-12-11 — — CN disclosed
WO-2007027734-A2 BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES CHEMOCENTRYX, INC. (US) 2007-03-08 — — WO disclosed
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