SCHEMBL27392425

SCHEMBL27392425

CC(C)(C)CCC1CC[C@H](c2ccc(Cl)cc2)C1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.40
DRD2 P14416 1/20 0.40
ESR2 Q92731 2/20 0.38
CYP2C9 P11712 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
LSS P48449 1/20 0.35
KDM1A O60341 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
IDO1 P14902 1/20 0.35
SRD5A1 P18405 2/20 0.35

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
SCHEMBL12031931 0.82 DRD2 (0.50) HTR3ADRD2CYP2C9LSS
SCHEMBL10177557 0.78 DRD2 (0.49) HTR3ADRD2ESR2CYP2C9LSS
SCHEMBL15627273 0.76 CNR2 (0.42) HTR3ADRD2ESR2LSSKDM1A
SCHEMBL27393727 0.76 SLC2A1 (0.39) HTR3ADRD2ESR2CYP2C9LSS
SCHEMBL10177748 0.75 HTR2A (0.49) HTR3ADRD2ESR2CYP2C9HTR2A
SCHEMBL10692927 0.75 ESR2 (0.55) HTR3ADRD2ESR2CYP2C9IDO1
SCHEMBL8025867 0.75 CYP2C9 (0.59) HTR3ADRD2ESR2CYP2C9LSS
SCHEMBL260852 0.75 CYP2C9 (0.59) HTR3ADRD2ESR2CYP2C9LSS
SCHEMBL6451898 0.74 DRD2 (0.45) HTR3ADRD2CYP2C9LSSIDO1
SCHEMBL6451902 0.74 DRD2 (0.45) HTR3ADRD2CYP2C9LSSIDO1

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
WO-2024108198-A2 METHODS OF TREATING OBESITY WITH AN MC4R AGONIST RHYTHM PHARMACEUTICALS, INC. (US) 2024-05-23 WO disclosed