SCHEMBL6971646

SCHEMBL6971646

[CH2]n1cc(NC(C)=O)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
ALDH1A1 P00352 4/20 0.41
HTT P42858 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
NAPRT Q6XQN6 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
MAPT P10636 4/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.39
CA12 O43570 1/20 0.39
BRD4 O60885 1/20 0.39
NR1I2 O75469 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
MB P02144 1/20 0.39
CYP1A1 P04798 1/20 0.39
CA3 P07451 1/20 0.39

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
SCHEMBL6971648 0.78 HTT (0.64) SMN1; SMN2ALDH1A1HTTL3MBTL1NAPRT
SCHEMBL6966248 0.75 BCAT2 (0.56) HTTKMT2AMEN1RAB9AKDM4E
SCHEMBL17267019 0.74 HIF1A (0.48) HIF1ASMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL21719735 0.74 KDM1A (0.47) HIF1ASMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL4293848 0.74 NPC1 (0.52) SMN1; SMN2ALDH1A1HTTL3MBTL1NAPRT
SCHEMBL25043757 0.73 IDO1 (0.42) HIF1ASMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL4281610 0.70 EGFR (0.54) SMN1; SMN2HTTL3MBTL1NAPRTHSD17B10
Trifluoroacetic Acid SCHEMBL29505602 0.69 L3MBTL1 (0.53) HIF1ASMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL23570884 0.69 HIF1A (0.50) HIF1ASMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL23547595 0.69 HIF1A (0.44) HIF1ASMN1; SMN2ALDH1A1HTTL3MBTL1

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-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed