SCHEMBL28110786

SCHEMBL28110786

Cc1cccc(C)c1-c1ccccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 1/20 0.52
MYC P01106 1/20 0.48
GAA P10253 2/20 0.47
MGAM O43451 1/20 0.47
SI P14410 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HSD11B1 P28845 1/20 0.47
CYP2A6 P11509 1/20 0.46
KDM4E B2RXH2 1/20 0.45
DPP4 P27487 1/20 0.43
CYP1A1 P04798 1/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
HTR7 P34969 1/20 0.42

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
SCHEMBL521542 0.93 PLA2G7 (0.50) PLA2G7MYCGAAMGAMSI
SCHEMBL2232919 0.91 PLA2G7 (0.53) PLA2G7MYCGAAMGAMSI
SCHEMBL9678940 0.87 ALDH1A1 (0.52) PLA2G7GAAMGAMSIMGAM2
SCHEMBL13201408 0.86 ALDH1A1 (0.46) PLA2G7MYCGAAMGAMSI
SCHEMBL28589830 0.82 PLA2G7 (0.48) PLA2G7ALDH1A1LMNANPC1RAB9A
SCHEMBL28899579 0.82 MYC (0.58) MYCALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL5281695 0.81 PLA2G7 (0.47) PLA2G7MYCGAAMGAMSI
SCHEMBL321560 0.80 PLA2G7 (0.61) PLA2G7GAAMGAMSIMGAM2
SCHEMBL16589092 0.80 ALDH1A1 (0.47) PLA2G7GAAALDH1A1LMNAKDM4E
SCHEMBL3834191 0.80 MYC (0.53) MYCGAAALDH1A1LMNAKDM4E

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-106132414-A Aryl lactams inhibitors of kinases 百时美施贵宝公司 2016-11-16 CN disclosed