SCHEMBL28114344

SCHEMBL28114344

CCC(CC)(CC(=O)Oc1ccccc1)C(=O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.45
CYP19A1 P11511 1/20 0.45
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
ESR1 P03372 1/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ACHE P22303 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
SCHEMBL19690575 0.88 ELANE (0.42) ELANECYP19A1ATML3MBTL1MAPT
SCHEMBL3179425 0.88 ELANE (0.47) ELANECYP19A1ATML3MBTL1MAPT
Ammonia Solution, Strong SCHEMBL27373723 0.86 ELANE (0.46) ELANECYP19A1ATML3MBTL1MAPT
SCHEMBL28083816 0.79 ELANE (0.47) ELANECYP19A1ATML3MBTL1KMT2A
SCHEMBL1255288 0.77 CYP19A1 (0.45) ELANECYP19A1ATML3MBTL1KMT2A
SCHEMBL453104 0.77 ELANE (0.46) ELANECYP19A1ATML3MBTL1MAPT
SCHEMBL2448081 0.77 L3MBTL1 (0.47) ELANECYP19A1ATML3MBTL1KMT2A
SCHEMBL8031952 0.77 ELANE (0.47) ELANEATML3MBTL1MAPTHSD17B10
SCHEMBL28180128 0.77 ELANE (0.45) ELANECYP19A1ATML3MBTL1KMT2A
Ammonia Solution, Strong SCHEMBL21219096 0.76 CYP19A1 (0.44) ELANECYP19A1ATML3MBTL1KMT2A

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-103980706-B Thermosetting resin composition and applications thereof 广东生益科技股份有限公司 2017-01-11 CN claimed