SCHEMBL25155135

SCHEMBL25155135

Cc1ccc(OCC2CCN2)cc1C(=O)NC1(c2cccc3ccccc23)CC1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CHRNB4 P30926 1/20 0.40
▸ CHRNA3 P32297 1/20 0.40
▸ MTNR1A P48039 1/20 0.35
▸ CHRNB2 P17787 1/20 0.35
▸ CHRNA4 P43681 1/20 0.35

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
SCHEMBL25156257 1.00 CHRNB4 (0.40) CHRNB4CHRNA3MTNR1ACHRNB2CHRNA4
SCHEMBL30344408 1.00 CHRNB4 (0.40) CHRNB4CHRNA3MTNR1ACHRNB2CHRNA4
SCHEMBL31360069 1.00 CHRNB4 (0.40) CHRNB4CHRNA3MTNR1ACHRNB2CHRNA4
SCHEMBL25155299 1.00 CHRNB4 (0.40) CHRNB4CHRNA3MTNR1ACHRNB2CHRNA4
SCHEMBL31360459 1.00 CHRNB4 (0.40) CHRNB4CHRNA3MTNR1ACHRNB2CHRNA4
SCHEMBL25155903 0.94 CHRNB4 (0.43) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL30344375 0.94 CHRNB4 (0.43) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL25155717 0.94 CHRNB4 (0.43) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL25155085 0.93 LTA4H (0.41) CHRNB4CHRNA3
SCHEMBL30344582 0.93 LTA4H (0.41) CHRNB4CHRNA3

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
WO-2023064493-A1 COMPOUNDS AND METHODS FOR TREATING CORONAVIRUSES Clear Creek Bio, Inc. (US) 2023-04-20 — — WO disclosed
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