SCHEMBL28813192

SCHEMBL28813192

O=C(O)Cc1cc2ccccn2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.48
POLB P06746 3/20 0.46
NSD2 O96028 1/20 0.46
GRK2 P25098 1/20 0.46
CASP6 P55212 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
METTL3 Q86U44 1/20 0.44
METTL14 Q9HCE5 1/20 0.44
LMNA P02545 3/20 0.43
PTGS1 P23219 2/20 0.43
GAA P10253 2/20 0.43
TSHR P16473 2/20 0.43
ABCC4 O15439 1/20 0.43
HTT P42858 1/20 0.43
PTGS2 P35354 1/20 0.42
FFAR1 O14842 1/20 0.40
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL27972306 0.81 PTGS1 (0.50) AKR1B1POLBNSD2GRK2CASP6
SCHEMBL28195327 0.81 METTL3 (0.42) POLBMETTL3METTL14KDM4EALDH1A1
SCHEMBL28042211 0.81 AKR1B1 (0.45) AKR1B1POLBNSD2GRK2CASP6
SCHEMBL27972289 0.79 ABCC4 (0.56) AKR1B1LMNAPTGS1GAATSHR
SCHEMBL2760780 0.78 NPC1 (0.43) POLBMETTL3METTL14TSHRKDM4E
SCHEMBL17372780 0.75 SMN1; SMN2 (0.41) POLBMETTL3METTL14LMNAKDM4E
SCHEMBL2940146 0.74 MAPT (0.43) POLBMETTL3METTL14LMNAGAA
SCHEMBL2691734 0.74 NPC1 (0.43) POLBMETTL3METTL14KDM4EALDH1A1
SCHEMBL1759104 0.73 CHRNA7 (0.49) POLBPTGS1TSHRPTGS2KDM4E
SCHEMBL27620623 0.72 TSHR (0.52) POLBMETTL3METTL14TSHRKDM4E

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
CN-103923105-A 2-indolizine formylamine compound as well as preparation method and application thereof UNIV BEIJING 2014-07-16 CN disclosed