SCHEMBL28357403

SCHEMBL28357403

CCn1c(=O)oc(=O)c2c(OC)cccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.44
NQO1 P15559 1/20 0.43
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
MIF P14174 4/20 0.40
CD74 P04233 2/20 0.40
MAOA P21397 1/20 0.40
AR P10275 1/20 0.39
PLA2G2A P14555 2/20 0.39
HTR1A P08908 1/20 0.39
HTR7 P34969 1/20 0.39
POLB P06746 1/20 0.39
CBX7 O95931 1/20 0.38
CDYL2 Q8N8U2 1/20 0.38
CDYL Q9Y232 1/20 0.38
CDY1; CDY1B Q9Y6F8 1/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 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
SCHEMBL24073980 0.87 MEN1 (0.48) MEN1GAAKMT2APOLBHPGD
SCHEMBL30339031 0.87 MEN1 (0.48) MEN1GAAKMT2APOLBHPGD
SCHEMBL25063109 0.86 CNR2 (0.47) ELANEHTR1AHTR7HPGDTSHR
SCHEMBL28357440 0.83 TNFRSF1A (0.45) ELANENQO1MEN1GAAKMT2A
SCHEMBL28357308 0.83 MIF (0.54) MIFCD74PLA2G2APOLB
SCHEMBL28357125 0.83 ELANE (0.41) ELANENQO1MEN1GAAKMT2A
SCHEMBL28357203 0.81 KMT2A (0.49) MEN1KMT2AMIFCD74PLA2G2A
SCHEMBL15991573 0.81 ALDH1A1 (0.40) MEN1KMT2AMIFCD74MAOA
SCHEMBL24074349 0.80 ELANE (0.41) ELANEKMT2APOLBUSP2HPGD
SCHEMBL9790070 0.80 ELANE (0.48) ELANENQO1MEN1GAAKMT2A

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-107141288-B Evodiamine compounds and preparation method and application thereof 中山大学 2019-12-27 CN disclosed