SCHEMBL6208230

SCHEMBL6208230

C=C(C(=O)OOc1ccccc1F)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.41
PARP10 Q53GL7 1/20 0.40
CXCL8 P10145 1/20 0.40
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
F2 P00734 1/20 0.37
LMNA P02545 1/20 0.37
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 2/20 0.35
FAAH O00519 1/20 0.35
GAA P10253 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35

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
SCHEMBL6204389 0.91 ATM (0.46) ATMTDP1MRGPRX4PARP10CXCL8
SCHEMBL6206062 0.81 ATM (0.51) ATMTDP1MRGPRX4LMNAKMT2A
SCHEMBL6204759 0.81 TDP1 (0.51) ATMTDP1PPARGF2LMNA
SCHEMBL6206638 0.81 ATM (0.48) ATMTDP1MRGPRX4F2LMNA
SCHEMBL6206051 0.81 TDP1 (0.48) ATMTDP1F2LMNAALDH1A1
SCHEMBL6205994 0.81 TDP1 (0.48) ATMTDP1CXCL8F2LMNA
SCHEMBL9124237 0.78 TDP1 (0.53) ATMTDP1F2LMNAALDH1A1
SCHEMBL6204946 0.78 ATM (0.49) ATMTDP1F2LMNAALDH1A1
SCHEMBL6206293 0.77 ALDH1A1 (0.54) ATMTDP1LMNAALDH1A1KMT2A
SCHEMBL6206401 0.77 ATM (0.44) ATMTDP1MRGPRX4F2LMNA

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