SCHEMBL23850127

SCHEMBL23850127

CC(OC(=O)N1CCC1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.55
HCAR2 Q8TDS4 1/20 0.49
LTB4R Q15722 1/20 0.47
LTB4R2 Q9NPC1 1/20 0.47
TSHR P16473 1/20 0.47
GAA P10253 1/20 0.46
MGLL Q99685 1/20 0.44
CHRM1 P11229 2/20 0.44
CYP2D6 P10635 3/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL5697155 0.97 GRIN2B (0.55) GRIN2BHCAR2LTB4RLTB4R2TSHR
SCHEMBL30826821 0.95 GRIN2B (0.54) GRIN2BHCAR2LTB4RLTB4R2TSHR
SCHEMBL31024103 0.87 GRIN2B (0.48) GRIN2BHCAR2LTB4RLTB4R2TSHR
SCHEMBL4679033 0.86 GRIN2B (0.52) GRIN2BHCAR2TSHRGAAMGLL
SCHEMBL12551259 0.84 GRIN2B (0.51) GRIN2BHCAR2TSHRGAAMGLL
SCHEMBL14802593 0.84 GRIN2B (0.60) GRIN2BHCAR2LTB4RLTB4R2TSHR
SCHEMBL14804120 0.82 HPGD (0.48) GRIN2BGAACYP2C9POLBKMT2A
SCHEMBL15279364 0.82 GRIN2B (0.43) GRIN2BLTB4RLTB4R2GAACYP2C9
SCHEMBL8736735 0.80 KMT2A (0.57) POLBKMT2AKDM4EMAPTHPGD
SCHEMBL27797456 0.80 KMT2A (0.45) GRIN2BLTB4RLTB4R2GAAPOLB

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-3883925-A1 CYCLIC UREAS Sironax Ltd (KY) 2021-09-29 EP disclosed