SCHEMBL21150668

SCHEMBL21150668

CC1CC2(C1)NC(=O)N(C)C2=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
CYP2C19 P33261 1/20 0.36
CRBN Q96SW2 1/20 0.33
LMNA P02545 1/20 0.33
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
MAPT P10636 1/20 0.31
CYP19A1 P11511 1/20 0.31
HTT P42858 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL21150993 0.80 LMNA (0.50) LMNAMAPTHTTMEN1KMT2A
SCHEMBL10204552 0.79 SIGMAR1 (0.36) TSHRCYP2C19IDO1TDO2
SCHEMBL21371646 0.78 POLB (0.40) TSHRCYP2C19LMNAIDO1TDO2
SCHEMBL24974722 0.75 BACE1 (0.38) CRBNLMNAMAPTCYP19A1
SCHEMBL21371642 0.74 POLB (0.46) TSHRCYP2C19LMNAIDO1TDO2
SCHEMBL24127455 0.74 TSHR (0.38) TSHRCYP2C19CRBNLMNAIDO1
SCHEMBL21371635 0.74 TSHR (0.38) TSHRCYP2C19CRBNLMNAIDO1
SCHEMBL8363999 0.74 POLB (0.50) LMNAMAPTKMT2A
SCHEMBL8363998 0.72 POLB (0.53) LMNAMAPTKMT2A
SCHEMBL19833566 0.72 TSHR (0.37) TSHRCYP2C19LMNAIDO1TDO2

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-2019136442-A1 CD16A BINDING AGENTS AND USES THEREOF KLEO PHARMACEUTICALS, INC. (US) 2019-07-11 WO disclosed