SCHEMBL8840693

SCHEMBL8840693

CC/C(=C\c1cn(C)c2ccccc12)C(=O)NC(=N)N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.47
ALDH1A1 P00352 6/20 0.46
HPGD P15428 2/20 0.46
LMNA P02545 2/20 0.46
KMT2A Q03164 6/20 0.46
MEN1 O00255 5/20 0.46
GAA P10253 3/20 0.46
IMPDH2 P12268 1/20 0.45
RAB9A P51151 2/20 0.44
HCRTR1 O43613 1/20 0.44
MAPT P10636 5/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NPC1 O15118 2/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
POLB P06746 2/20 0.42
NR4A2 P43354 1/20 0.41
TNFRSF1A P19438 1/20 0.40

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
SCHEMBL2134418 0.80 KMT2A (0.57) ATMALDH1A1HPGDLMNAKMT2A
SCHEMBL2134420 0.80 KMT2A (0.57) ATMALDH1A1HPGDLMNAKMT2A
SCHEMBL8840728 0.73 SLC2A1 (0.39) ATMALDH1A1HPGDLMNAKMT2A
Hydrochloric Acid SCHEMBL8692450 0.70 NR4A2 (0.56) ALDH1A1LMNAKMT2AMEN1RAB9A
SCHEMBL1277185 0.68 HPGDS (0.35)
SCHEMBL1708743 0.68 HPGDS (0.35)
SCHEMBL15984842 0.68 KMT2A (0.66) ATMALDH1A1HPGDLMNAKMT2A
SCHEMBL23046854 0.67 KMT2A (0.69) ATMALDH1A1HPGDLMNAKMT2A
SCHEMBL25954417 0.67 MEN1 (0.57) ATMALDH1A1HPGDLMNAKMT2A
SCHEMBL18539720 0.67 MAPT (0.51) ATMALDH1A1HPGDLMNAKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9067340-A None JP disclosed
JP-H0967340-A N-(2-PROPENOYL)GUANIDINE DERIVATIVE YAMANOUCHI PHARMACEUT CO LTD 1997-03-11 JP disclosed