SCHEMBL6205997

SCHEMBL6205997

O=C(O)C(=C(Cl)Oc1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.43
PARP10 Q53GL7 1/20 0.41
NSD2 O96028 1/20 0.41
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
AKR1C3 P42330 1/20 0.39
F2 P00734 1/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 2/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP1A2 P05177 1/20 0.38
DAO P14920 1/20 0.38
TSHR P16473 1/20 0.38
NAPRT Q6XQN6 1/20 0.38

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
SCHEMBL6206403 0.84 ELANE (0.43) ELANEPARP10NSD2TDP1L3MBTL1
SCHEMBL6204762 0.78 ELANE (0.53) ELANEPARP10NSD2TDP1L3MBTL1
SCHEMBL6206652 0.77 ELANE (0.43) ELANEPARP10NSD2TDP1L3MBTL1
SCHEMBL6206053 0.77 ELANE (0.43) ELANEPARP10NSD2TDP1L3MBTL1
SCHEMBL6206639 0.77 ELANE (0.43) ELANEPARP10NSD2TDP1L3MBTL1
SCHEMBL10919338 0.74 CES1 (0.48) TDP1L3MBTL1ATMMAPTHPGD
SCHEMBL1145279 0.74 ELANE (0.51) ELANETDP1L3MBTL1MAPTF2
SCHEMBL6204948 0.74 ELANE (0.51) ELANETDP1L3MBTL1MAPTF2
SCHEMBL6206065 0.74 TSHR (0.47) ELANETDP1L3MBTL1MAPTALDH1A1
SCHEMBL523842 0.73 CES1 (0.58) TDP1L3MBTL1ATMMAPTHPGD

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
EP-1532128-A1 INHIBITORS OF HCV NS5B POLYMERASE Pharmacia & Upjohn Company LLC (US) 2005-05-25 EP disclosed
WO-2004002977-A1 INHIBITORS OF HCV NS5B POLYMERASE PHARMACIA & UPJOHN COMPANY LLC (US) 2004-01-08 WO disclosed