SCHEMBL24631671

SCHEMBL24631671

Cc1ccc2c(n1)[C@@H](CNC(=O)OC(C)(C)C)Cc1ccccc1O2

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 12/20 0.42
▸ ACACA Q13085 7/20 0.42
▸ DRD2 P14416 1/20 0.40
▸ CKS1B P61024 1/20 0.39
▸ SKP1 P63208 1/20 0.39
▸ SKP2 Q13309 1/20 0.39
▸ NAMPT P43490 2/20 0.38
▸ BCHE P06276 1/20 0.37
▸ RORC P51449 1/20 0.36

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
SCHEMBL24631462 1.00 ACACB (0.42) ACACBACACADRD2CKS1BSKP1
SCHEMBL30134797 1.00 ACACB (0.42) ACACBACACADRD2CKS1BSKP1
SCHEMBL24631825 0.90 ACACB (0.43) ACACBACACADRD2CKS1BSKP1
SCHEMBL30134736 0.90 ACACB (0.43) ACACBACACADRD2CKS1BSKP1
SCHEMBL24631455 0.90 ACACB (0.43) ACACBACACADRD2CKS1BSKP1
SCHEMBL30134766 0.86 ACACB (0.41) ACACBACACADRD2CKS1BSKP1
SCHEMBL30134764 0.86 ACACB (0.41) ACACBACACADRD2CKS1BSKP1
SCHEMBL24631674 0.86 ACACB (0.41) ACACBACACADRD2CKS1BSKP1
SCHEMBL24631670 0.86 ACACB (0.41) ACACBACACADRD2CKS1BSKP1
SCHEMBL30031182 0.80 ACACB (0.40) ACACBACACADRD2CKS1BSKP1

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-2022217265-A1 TAAR1 AND SEROTONIN MODULATORS, AND PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2022-10-13 — — WO disclosed
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