SCHEMBL6972597

SCHEMBL6972597

COC(=O)Oc1c[c]ccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 3/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
MTNR1A P48039 10/20 0.33
MTNR1B P49286 10/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP14 P50281 1/20 0.33
LMNA P02545 1/20 0.32
HTT P42858 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
SCHEMBL6969776 0.83 TDP1 (0.40) HSD17B10KDM4EHPGDKMT2AMEN1
SCHEMBL129259 0.81 LMNA (0.48) HSD17B10KDM4EKMT2AMEN1ALDH1A1
SCHEMBL6670309 0.81 KMT2A (0.40) KDM4EHPGDKMT2AMEN1ALDH1A1
SCHEMBL14814745 0.81 ELANE (0.51) KDM4EALDH1A1
SCHEMBL5396445 0.80 ACHE (0.43) HSD17B10KDM4EHPGDKMT2AMEN1
SCHEMBL9817182 0.80 ELANE (0.49) KMT2AMEN1LMNA
SCHEMBL6292065 0.80 NCEH1 (0.40) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL8500041 0.78 ELANE (0.36)
SCHEMBL4260342 0.76 RAB9A (0.57) KMT2AMEN1ALDH1A1LMNA
SCHEMBL128694 0.76 ACHE (0.49) HSD17B10KDM4EHPGDKMT2AMEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0687249-A1 BALANOIDS ELI LILLY AND COMPANY (US) 1995-12-20 EP claimed
WO-1994020062-A2 BALANOIDS AS PROTEIN KINASE C INHIBITORS ELI LILLY AND COMPANY (US) 1994-09-15 WO claimed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
EP-0687249-A1 BALANOIDS ELI LILLY AND COMPANY (US) 1995-12-20 EP disclosed
WO-1994020062-A2 BALANOIDS AS PROTEIN KINASE C INHIBITORS ELI LILLY AND COMPANY (US) 1994-09-15 WO disclosed