SCHEMBL24631455

SCHEMBL24631455

CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2Oc2ccc(Cl)nc21

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 8/20 0.43
▸ ACACA Q13085 5/20 0.43
▸ DRD2 P14416 2/20 0.42
▸ NAMPT P43490 4/20 0.40
▸ CKS1B P61024 1/20 0.39
▸ SKP1 P63208 1/20 0.39
▸ SKP2 Q13309 1/20 0.39
▸ BCHE P06276 1/20 0.37
▸ FNTA P49354 1/20 0.37
▸ FNTB P49356 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ KMT2A Q03164 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
SCHEMBL24631825 1.00 ACACB (0.43) ACACBACACADRD2NAMPTCKS1B
SCHEMBL30134736 1.00 ACACB (0.43) ACACBACACADRD2NAMPTCKS1B
SCHEMBL24631671 0.90 ACACB (0.42) ACACBACACADRD2NAMPTCKS1B
SCHEMBL30134797 0.90 ACACB (0.42) ACACBACACADRD2NAMPTCKS1B
SCHEMBL24631462 0.90 ACACB (0.42) ACACBACACADRD2NAMPTCKS1B
SCHEMBL30134766 0.86 ACACB (0.41) ACACBACACADRD2NAMPTCKS1B
SCHEMBL30134764 0.86 ACACB (0.41) ACACBACACADRD2NAMPTCKS1B
SCHEMBL24631674 0.86 ACACB (0.41) ACACBACACADRD2NAMPTCKS1B
SCHEMBL24631670 0.86 ACACB (0.41) ACACBACACADRD2NAMPTCKS1B
SCHEMBL24631608 0.78 DRD2 (0.40) ACACBACACADRD2NAMPT

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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