SCHEMBL23640440

SCHEMBL23640440

CC1C=CC(OCCNS(C)(=O)=O)=CC1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
HTT P42858 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PKM P14618 2/20 0.35
LMNA P02545 1/20 0.33
MAPT P10636 2/20 0.33
ROCK2 O75116 2/20 0.33
MAP4K4 O95819 2/20 0.33
PIM1 P11309 2/20 0.33
PRKACA P17612 2/20 0.33
CDK2 P24941 2/20 0.33
GSK3B P49841 2/20 0.33
HIPK2 Q9H2X6 2/20 0.33
DYRK3 O43781 1/20 0.33
PRKD3 O94806 1/20 0.33
CDK1 P06493 1/20 0.33
ROS1 P08922 1/20 0.33
RPS6KB1 P23443 1/20 0.33
AKT1 P31749 1/20 0.33

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
SCHEMBL24302273 1.00 ALDH1A1 (0.40) ALDH1A1HTTMEN1KMT2APKM
SCHEMBL24302261 0.79 HTR1B (0.39) KDM4E
SCHEMBL23640163 0.79 HTR1B (0.39) KDM4E
SCHEMBL24302330 0.76 MTNR1A (0.46) ALDH1A1LMNAKDM4E
SCHEMBL23640279 0.76 MTNR1A (0.46) ALDH1A1LMNAKDM4E
SCHEMBL23640442 0.73 SLC6A4 (0.31)
SCHEMBL24302321 0.72
SCHEMBL23640445 0.72
SCHEMBL23640253 0.69 MAPT (0.37) ALDH1A1MAPT
SCHEMBL25015134 0.68 MRGPRX2 (0.40)

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-3848367-A1 TRICYCLIC COMPOUNDS ACTING ON CRBN PROTEINS Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-07-14 EP disclosed