SCHEMBL4055221

SCHEMBL4055221

CC(C)(C)OC(=O)Oc1ccc(C2CCC(c3ccc(OC(=O)OC(C)(C)C)cc3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.60
KDM1A O60341 1/20 0.58
GPR119 Q8TDV5 2/20 0.39
NAMPT P43490 1/20 0.39
RAB9A P51151 2/20 0.39
CA2 P00918 1/20 0.39
CYP2C9 P11712 2/20 0.38
LMNA P02545 3/20 0.37
TSHR P16473 1/20 0.37
BLM P54132 1/20 0.37
PPARA Q07869 1/20 0.37
KMT2A Q03164 2/20 0.37
ESR2 Q92731 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
MAPKAPK2 P49137 1/20 0.37
LSS P48449 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL4063867 0.89 CYP2C9 (0.56) ELANEKDM1AGPR119RAB9ACYP2C9
SCHEMBL4063870 0.89 CYP2C9 (0.56) ELANEKDM1AGPR119RAB9ACYP2C9
SCHEMBL4058753 0.85 KDM1A (0.46) ELANEKDM1AGPR119RAB9ACYP2C9
SCHEMBL4058749 0.85 KDM1A (0.46) ELANEKDM1AGPR119RAB9ACYP2C9
SCHEMBL4061370 0.84 ELANE (0.81) ELANEKDM1ARAB9ACA2LMNA
SCHEMBL16273375 0.80 KDM1A (0.65) ELANEKDM1ACA2MAPT
SCHEMBL17712529 0.80 KDM1A (0.65) ELANEKDM1ACA2MAPT
SCHEMBL22489653 0.79 ALDH1A1 (0.53) GPR119NAMPTRAB9AHTTSMN1; SMN2
SCHEMBL4059798 0.78 ELANE (0.72) ELANEKDM1ARAB9ACA2LMNA
SCHEMBL12228673 0.77 ELANE (0.66) ELANEKDM1ARAB9ACA2LMNA

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
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed