SCHEMBL10634752

SCHEMBL10634752

CCCCCC1c2cccc(O)c2C(=O)c2c(OC(C)=O)cccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.50
ELANE P08246 3/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
PTGS2 P35354 5/20 0.43
CTSG P08311 2/20 0.42
POLM Q9NP87 1/20 0.42
POLK Q9UBT6 1/20 0.42
POLL Q9UGP5 1/20 0.42
POLH Q9Y253 1/20 0.42
SLC37A4 O43826 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ABCC4 O15439 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TTR P02766 1/20 0.40
TP53 P04637 1/20 0.40
HSP90AA1 P07900 1/20 0.40

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
SCHEMBL10490983 0.86 CES2 (0.63) CES2ELANECTSGMEN1ALDH1A1
SCHEMBL10630402 0.86 CES2 (0.52) CES2ELANECTSGMEN1LMNA
SCHEMBL10628386 0.82 PIM1 (0.43) KDM4EMEN1ABCC4USP2ALDH1A1
SCHEMBL10634901 0.79 PIM1 (0.46) KDM4EMEN1ABCC4USP2ALDH1A1
SCHEMBL24072440 0.76 PPARG (0.43) CES2ELANEPPARGPPARAPTGS2
SCHEMBL8624814 0.76 ELANE (0.52) CES2ELANECTSGSLC37A4
SCHEMBL10634860 0.75 PTPN1 (0.43) CES2MEN1LMNACHRM2ADRA2A
SCHEMBL10779985 0.74 KDM4E (0.46) ELANEPPARGPPARAPTGS2KDM4E
SCHEMBL9538649 0.73 MEN1 (0.64) ELANECTSGKDM4EMEN1ABCC4
SCHEMBL8077270 0.73 CES2 (0.50) CES2ELANECTSG

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
US-4755530-A 1-hydroxy-8-acyloxy-10-acyl anthrones, process for their preparation and their use in human or veterinary medicines and in cosmetic formulations CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (C.I.R.D) (FR) 1988-07-05 US disclosed