SCHEMBL4650759

SCHEMBL4650759

CC(=O)c1cc(C)c(C)cc1NCC(=O)Nc1ccccc1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 5/20 0.51
LMNA P02545 4/20 0.51
KDM4E B2RXH2 3/20 0.51
MAPT P10636 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
GAA P10253 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HPGD P15428 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
POLB P06746 1/20 0.48
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
HTT P42858 1/20 0.47
MEN1 O00255 1/20 0.46
AGTR1 P30556 1/20 0.46
HCAR2 Q8TDS4 2/20 0.46
CYP2C9 P11712 1/20 0.45
CTSK P43235 1/20 0.45

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
SCHEMBL4651062 0.90 ALDH1A1 (0.47) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL4650312 0.90 ALDH1A1 (0.47) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL4650471 0.90 ALDH1A1 (0.47) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL4698263 0.88 ALDH1A1 (0.49) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL4650357 0.86 KMT2A (0.59) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL4650280 0.86 KMT2A (0.50) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL4650518 0.86 KMT2A (0.50) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL29193536 0.84 KMT2A (0.59) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL4650402 0.82 POLB (0.52) KMT2AALDH1A1LMNAKDM4EMAPT
SCHEMBL4650557 0.82 KDM4E (0.53) KMT2AALDH1A1LMNAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966181-A2 ANTHRANILIC ACID DERIVATIVES USEFUL IN TREATING INFECTION WITH HEPATITIS C VIRUS Wyeth (US) 2008-09-10 EP claimed
WO-2008051244-A2 ANTHRANILIC ACID DERIVATIVES USEFUL IN TREATING INFECTION WITH HEPATITIS C VIRUS WYETH (US) 2008-05-02 WO claimed
EP-1966181-A2 ANTHRANILIC ACID DERIVATIVES USEFUL IN TREATING INFECTION WITH HEPATITIS C VIRUS Wyeth (US) 2008-09-10 EP disclosed
WO-2008051244-A2 ANTHRANILIC ACID DERIVATIVES USEFUL IN TREATING INFECTION WITH HEPATITIS C VIRUS WYETH (US) 2008-05-02 WO disclosed