SCHEMBL17023215

SCHEMBL17023215

COC(=O)Oc1nn(CCc2ccccc2)cc1NC(=O)CCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.45
HPGD P15428 2/20 0.45
POLB P06746 2/20 0.44
RAB9A P51151 5/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HTT P42858 2/20 0.43
MAPT P10636 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM6B O15054 1/20 0.42
KDM4D Q6B0I6 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
EGLN3 Q9H6Z9 1/20 0.42
GAA P10253 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
SCHEMBL17023221 0.86 L3MBTL1 (0.47) KDM4ESMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL17023223 0.83 GAA (0.48) SMN1; SMN2POLBALDH1A1MEN1KMT2A
SCHEMBL17023229 0.83 L3MBTL1 (0.48) KDM4ESMN1; SMN2HPGDRAB9ANPC1
SCHEMBL17023214 0.83 ADORA3 (0.40) KDM4ESMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL17023217 0.83 LMNA (0.52) KDM4ESMN1; SMN2HPGDPOLBRAB9A
SCHEMBL17023231 0.83 LMNA (0.46) SMN1; SMN2RAB9ANPC1ALDH1A1MEN1
SCHEMBL17023233 0.82 KMT2A (0.46) SMN1; SMN2HPGDALDH1A1MEN1KMT2A
SCHEMBL17023227 0.82 L3MBTL1 (0.45) SMN1; SMN2ALDH1A1MEN1KMT2AMAPT
SCHEMBL1878308 0.82 KDM4E (0.57) KDM4ESMN1; SMN2HPGDPOLBRAB9A
SCHEMBL17023213 0.82 ADORA3 (0.35) KDM4ESMN1; SMN2RAB9ANPC1ALDH1A1

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-2059503-B1 AMINOPYRAZOLE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, AND COMPOSITION FOR PREVENTING OR TREATING ISCHEMIC DISEASES CONTAINING THE SAME KOREA RES INST CHEM TECH (KR) 2015-08-26 EP claimed