SCHEMBL24202026

SCHEMBL24202026

CC(C)(CC1CNc2ccccc21)N=O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 2/20 0.38
▸ HRH2 P25021 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ BCHE P06276 1/20 0.32
▸ EPHX2 P34913 1/20 0.32
▸ MTNR1A P48039 1/20 0.31
▸ MTNR1B P49286 1/20 0.31

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
SCHEMBL21282546 0.82 CCKBR (0.39) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL20505796 0.80 CCKBR (0.38) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL23758472 0.78 CCKBR (0.37) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL13142140 0.77 CCKBR (0.36) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL16684897 0.76 CCKBR (0.39) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL24201551 0.76 CCKBR (0.42) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL12141050 0.73 CCKBR (0.42) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL1118519 0.73 CCKBR (0.42) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL12013752 0.73 CCKBR (0.42) CCKBRHRH2OPRM1HTR2BBCHE
SCHEMBL10819639 0.73 ALDH1A1 (0.39) CCKBRHRH2OPRM1HTR2BEPHX2

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
EP-3939981-A1 FUSED THIAZOLOPYRIMIDINE DERIVATIVES AS MNKS INHIBITORS LifeArc (GB) 2022-01-19 — — EP disclosed
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