SCHEMBL21591072

SCHEMBL21591072

O=C(O)N1CC(F)(CO)C1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.32
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP3A4 P08684 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL16211926 0.83 VNN1 (0.33) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL21195994 0.83 VNN1 (0.33) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL21195953 0.83 VNN1 (0.33) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL23245626 0.81 KDM4E (0.34) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL12490749 0.80 NPC1 (0.34) KDM4EMEN1ALDH1A1CYP3A4KMT2A
SCHEMBL21196163 0.80 NPC1 (0.34) KDM4EMEN1ALDH1A1CYP3A4KMT2A
SCHEMBL18669380 0.80 NPC1 (0.34) KDM4EMEN1ALDH1A1CYP3A4KMT2A
SCHEMBL21585780 0.79
SCHEMBL30327233 0.79 SMN1; SMN2 (0.43) CNR2KDM4EMEN1USP2CYP3A4
SCHEMBL619913 0.77 VNN1 (0.36) KDM4EMEN1USP2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022266258-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF IRAK-4 ARVINAS OPERATIONS, INC. (US) 2022-12-22 WO disclosed
EP-3806853-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES Galapagos NV (BE) 2021-04-21 EP disclosed
WO-2019238424-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2019-12-19 WO disclosed
CN-110256418-A The benzamide that 1,3- thiazol-2-yl replaces 拜耳公司 2019-09-20 CN disclosed
CN-107207507-A 1, 3-thiazol-2-yl substituted benzamides 拜耳公司 2017-09-26 CN disclosed