SCHEMBL28480109

SCHEMBL28480109

CCC(=O)N1c2ccccc2[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.50
LMNA P02545 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
HTT P42858 1/20 0.49
BRD4 O60885 1/20 0.41
TSHR P16473 1/20 0.41
GFER P55789 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
BRD2 P25440 1/20 0.39

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
SCHEMBL30094342 0.90 LMNA (0.45) PTGDR2LMNASMN1; SMN2KMT2AMEN1
SCHEMBL30094273 0.89 KDM1A (0.48) PTGDR2LMNASMN1; SMN2KMT2AMEN1
SCHEMBL28482330 0.89 KDM1A (0.48) PTGDR2LMNASMN1; SMN2KMT2AMEN1
SCHEMBL29730703 0.89 KDM1A (0.48) PTGDR2LMNASMN1; SMN2KMT2AMEN1
SCHEMBL29730558 0.83 LMNA (0.45) PTGDR2LMNASMN1; SMN2BRD4GFER
SCHEMBL29730752 0.83 KDM1A (0.41) PTGDR2LMNASMN1; SMN2KMT2AMEN1
SCHEMBL29730720 0.82 NAMPT (0.42) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL29730609 0.81 LMNA (0.44) LMNASMN1; SMN2KMT2AMEN1HTT
SCHEMBL21423956 0.81 LMNA (0.57) PTGDR2LMNASMN1; SMN2KMT2AMEN1
SCHEMBL18258876 0.80 P2RY1 (0.49) PTGDR2KMT2AL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114502534-A BET degradant 协和麒麟株式会社 2022-05-13 CN disclosed
CN-111936468-A Compounds with anti-cancer activity 协和麒麟株式会社 2020-11-13 CN disclosed