SCHEMBL2410091

SCHEMBL2410091

CC(=O)Cc1cccnc1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.44
KDM4E B2RXH2 2/20 0.43
CYP1A2 P05177 2/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 5/20 0.40
LMNA P02545 3/20 0.40
NPC1 O15118 2/20 0.40
TSHR P16473 2/20 0.40
GLA P06280 1/20 0.40
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
P2RX7 Q99572 1/20 0.39
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
MMP8 P22894 2/20 0.38
MMP13 P45452 2/20 0.38
HTT P42858 1/20 0.38
HPGD P15428 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
SCHEMBL9668925 0.83 KDM4E (0.62) NAPRTL3MBTL1KDM4ECYP1A2MAPT
SCHEMBL12797894 0.80 KMT2A (0.38) L3MBTL1CYP1A2NPC1TSHRMEN1
SCHEMBL13568061 0.79 L3MBTL1 (0.45) L3MBTL1KDM4ECYP1A2MAPTALDH1A1
SCHEMBL13568063 0.79 P2RX7 (0.47) L3MBTL1KDM4ECYP1A2MAPTALDH1A1
SCHEMBL9370451 0.78 MAPT (0.49) NAPRTL3MBTL1KDM4EMAPTALDH1A1
SCHEMBL13925527 0.78
SCHEMBL6989753 0.78
SCHEMBL3110927 0.78 SMN1; SMN2 (0.47) L3MBTL1KDM4ECYP1A2MAPTALDH1A1
SCHEMBL27620072 0.78 L3MBTL1 (0.44) L3MBTL1KDM4ECYP1A2MAPTALDH1A1
SCHEMBL19323009 0.77 L3MBTL1 (0.50) NAPRTL3MBTL1LMNAMEN1KMT2A

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
EP-2364979-A1 Pyrrole compounds Takeda Pharmaceutical Company Limited (JP) 2011-09-14 EP disclosed