SCHEMBL9565118

SCHEMBL9565118

COC(=O)CCC1CC(C)CC(C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
ALDH1A1 P00352 4/20 0.33
FKBP1A P62942 3/20 0.33
FKBP4 Q02790 2/20 0.33
FKBP5 Q13451 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 3/20 0.33
HTT P42858 2/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
NPC1 O15118 2/20 0.32
NR2F2 P24468 2/20 0.32
RAB9A P51151 2/20 0.32
HIF1A Q16665 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
MAPK1 P28482 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL9013962 0.77 TSHR (0.38) TSHRALDH1A1TDP1LMNAHTT
SCHEMBL9014001 0.76 TLR4 (0.45) TSHRALDH1A1TDP1LMNASMN1; SMN2
SCHEMBL9014348 0.73 TSHR (0.36) TSHRALDH1A1TDP1LMNAHTT
SCHEMBL22754195 0.73 TSHR (0.43) TSHRALDH1A1TDP1LMNAHTT
SCHEMBL10614279 0.72 TSHR (0.46) TSHRALDH1A1TDP1LMNAHTT
SCHEMBL1754902 0.71 SMN1; SMN2 (0.38) ALDH1A1FKBP1AFKBP4FKBP5LMNA
SCHEMBL10848706 0.70 TSHR (0.40) TSHRALDH1A1TDP1LMNAHTT
SCHEMBL22680909 0.70 TSHR (0.33) TSHRALDH1A1TDP1LMNAHTT
SCHEMBL11763977 0.67 NPC1 (0.54) TSHRALDH1A1TDP1LMNAHTT
SCHEMBL9511515 0.66 TSHR (0.50) TSHRALDH1A1TDP1LMNAMAPT

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-0551019-A1 Catalytic process of producing coumarin and derivatives thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-07-14 EP disclosed