SCHEMBL10694480

SCHEMBL10694480

C/C=C(/C(=O)O)c1csc(NC(C)=O)n1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.69
KDM4E B2RXH2 3/20 0.54
HSD17B10 Q99714 2/20 0.54
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.49
KMT2A Q03164 1/20 0.49
ABL1 P00519 4/20 0.44
NPC1 O15118 4/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 3/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
DHFR P00374 3/20 0.43
EGFR P00533 3/20 0.43
PIM1 P11309 1/20 0.43
PIM3 Q86V86 1/20 0.43
TYR P14679 1/20 0.43

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
SCHEMBL10694485 1.00 L3MBTL1 (0.69) L3MBTL1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL10746814 0.82 L3MBTL1 (0.70) L3MBTL1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL10746638 0.82 L3MBTL1 (0.70) L3MBTL1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL758061 0.82 L3MBTL1 (1.00) L3MBTL1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL10996450 0.80 L3MBTL1 (0.44) L3MBTL1SMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL10691329 0.80 CYP1A2 (0.56) L3MBTL1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL10990005 0.80 L3MBTL1 (0.44) L3MBTL1SMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL10428684 0.80 L3MBTL1 (0.55) L3MBTL1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL10428930 0.80 CYP1A2 (0.56) L3MBTL1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL10691872 0.80 CYP1A2 (0.56) L3MBTL1KDM4EHSD17B10MAPTSMN1; SMN2

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
US-4782162-A Novel intermediates for the synthesis of cephalosporins BAYER AKTIENGESELLSCHAFT (DE) 1988-11-01 US disclosed
EP-0161617-A2 Intermediates and process for the preparation of intermediates in the synthesis of cephalosporins BAYER AG (DE) 1985-11-21 EP disclosed