SCHEMBL30740682

SCHEMBL30740682

COC(=O)c1occc1C(C)O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 1/20 0.40
ATM Q13315 1/20 0.40
TSHR P16473 2/20 0.38
LMNA P02545 2/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPK1 P28482 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
CFTR P13569 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
KLKB1 P03952 1/20 0.34

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
SCHEMBL2301583 0.87 MAPT (0.40) KMT2AKDM4ETSHRLMNAALDH1A1
SCHEMBL43076 0.73 KDM4E (0.53) KMT2AKDM4EGAATSHRLMNA
SCHEMBL69723 0.73 HSD17B10 (0.44) KMT2AKDM4EGAAATMTSHR
SCHEMBL28296968 0.72 CA12 (0.42) KDM4EGAATSHRLMNAALDH1A1
SCHEMBL189803 0.72 ALDH1A1 (0.46) KMT2AKDM4EGAAATMTSHR
SCHEMBL30368537 0.72 KDM4E (0.38) KMT2AKDM4EGAATSHRLMNA
SCHEMBL22068300 0.72 CHRNA4 (0.48) KDM4EGAATSHRLMNAALDH1A1
SCHEMBL8217350 0.72 KDM4E (0.38) KMT2AKDM4ETSHRLMNAALDH1A1
SCHEMBL31310778 0.72 HSD17B10 (0.43) KMT2AKDM4EGAAATMTSHR
SCHEMBL2417181 0.72 CHRNB2 (0.41) KMT2AKDM4EGAATSHRALDH1A1

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
CN-117043154-A GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof 卡莫特医疗有限公司 2023-11-10 CN disclosed