SCHEMBL6473034

SCHEMBL6473034

Cc1ccccc1C(=CC(N)=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
MYC P01106 1/20 0.42
HPGD P15428 1/20 0.42
KCNK3 O14649 1/20 0.42
KCNK9 Q9NPC2 1/20 0.42
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
SLC6A1 P30531 2/20 0.41
POLB P06746 2/20 0.41
CYP3A4 P08684 1/20 0.41
PARP1 P09874 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41

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
SCHEMBL3406406 0.81 TDP1 (0.54) ALDH1A1POLBCYP3A4PARP1MAPT
SCHEMBL29216340 0.80 RAB9A (0.46) RAB9ANPC1MYCHPGDALDH1A1
SCHEMBL6446499 0.79 ERCC5 (0.41) RAB9ANPC1HPGDKCNK3KCNK9
SCHEMBL7925207 0.77 NPC1 (0.42) RAB9ANPC1HPGDKCNK3KCNK9
SCHEMBL6548199 0.77 NPC1 (0.42) RAB9ANPC1HPGDKCNK3KCNK9
SCHEMBL9359645 0.77 ERCC5 (0.46) RAB9ANPC1MYCHPGDALDH1A1
SCHEMBL9359661 0.77 ERCC5 (0.46) RAB9ANPC1MYCHPGDALDH1A1
SCHEMBL20658848 0.77 ALDH1A1 (0.51) RAB9ANPC1ALDH1A1SMN1; SMN2POLB
SCHEMBL14677024 0.75 RAB9A (0.41) RAB9ANPC1MYCHPGDALDH1A1
SCHEMBL28884331 0.75 RAB9A (0.41) RAB9ANPC1MYCHPGDALDH1A1

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
WO-2005007094-A2 ASTHMA AND ALLERGIC INFLAMMATION MODULATORS TULARIK INC. (US) 2005-01-27 WO disclosed