SCHEMBL6155638

SCHEMBL6155638

C=C(C)Cn1ncc(C(=O)OC)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
SPR P35270 3/20 0.41
SMN1; SMN2 Q16637 4/20 0.39
MAPT P10636 3/20 0.38
TP53 P04637 1/20 0.38
PPARG P37231 1/20 0.38
NCOA2 Q15596 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
LMNA P02545 1/20 0.37
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 4/20 0.36
RAB9A P51151 3/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 2/20 0.36
NPC1 O15118 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
DRD3 P35462 1/20 0.36
ALOX15 P16050 1/20 0.35

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
SCHEMBL6153935 0.84 MAPK1 (0.45) KMT2ASMN1; SMN2MAPTLMNAKDM4E
SCHEMBL841372 0.81 LMNA (0.54) KMT2ASPRSMN1; SMN2MAPTTP53
SCHEMBL6156766 0.79 KMT2A (0.45) KMT2ASPRSMN1; SMN2MAPTTP53
SCHEMBL6155564 0.77 KMT2A (0.46) KMT2ASPRSMN1; SMN2MAPTTP53
SCHEMBL4715135 0.76 KMT2A (0.45) KMT2ASPRSMN1; SMN2LMNAALDH1A1
SCHEMBL1841148 0.75 RAB9A (0.44) KMT2ASMN1; SMN2MAPTTP53LMNA
SCHEMBL15176566 0.74 SMN1; SMN2 (0.60) KMT2ASMN1; SMN2MAPTTP53LMNA
SCHEMBL10184712 0.72 KMT2A (0.53) KMT2ASPRSMN1; SMN2MAPTTP53
SCHEMBL23206336 0.71 SMN1; SMN2 (0.52) KMT2ASMN1; SMN2MAPTLMNAKDM4E
SCHEMBL15175616 0.71 ALDH1A1 (0.47) KMT2ASMN1; SMN2MAPTKDM4EALDH1A1

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-1580189-A1 4-AMINO-5-METHYLPYRAZOLE DERIVATIVES AND PROCESS FOR PRODUCTION THEREOF Sankyo Agro Company, Limited (JP) 2005-09-28 EP disclosed