SCHEMBL13041392

SCHEMBL13041392

COC(=O)C1=CCC(C)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.40
LMNA P02545 3/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
THRB P10828 1/20 0.39
CHRM1 P11229 1/20 0.39
KCNH2 Q12809 1/20 0.38
PTPN1 P18031 1/20 0.38
TSHR P16473 2/20 0.38
CES2 O00748 1/20 0.38
GABRR1 P24046 1/20 0.38
BLM P54132 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 4/20 0.33
HSD17B10 Q99714 2/20 0.33
NPC1 O15118 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
SCHEMBL28996156 0.81 CHRM3 (0.40) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL13924886 0.81 GABRR1 (0.43) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL13041969 0.79 LMNA (0.50) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL818273 0.79 LMNA (0.46) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL1780881 0.79 LMNA (0.44) LMNATSHRCES2GABRR1ALDH1A1
SCHEMBL2874581 0.79 CES2 (0.58) LMNATSHRCES2GABRR1BLM
SCHEMBL13745963 0.79 CES2 (0.58) LMNATSHRCES2GABRR1BLM
SCHEMBL18614512 0.79 LMNA (0.44) LMNATSHRCES2GABRR1ALDH1A1
SCHEMBL10066924 0.79 LMNA (0.44) LMNATSHRCES2GABRR1ALDH1A1
SCHEMBL24776879 0.78 LMNA (0.38) LMNATSHRCES2GABRR1ALDH1A1

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
EP-2771740-B1 PHOTOSENSITIVE NEGATIVE RESIN COMPOSITION, FINE STRUCTURE, PRODUCTION PROCESS OF FINE STRUCTURE AND LIQUID EJECTION HEAD CANON KK (JP) 2017-03-15 EP disclosed
WO-2010148049-A2 PREPARATION OF TRANS, TRANS MUCONIC ACID AND TRANS, TRANS MUCONATES DRATHS CORPORATION (US) 2010-12-23 WO disclosed