SCHEMBL27730076

SCHEMBL27730076

Nc1nc(/C(=N/O)C(=O)S)cs1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GABRA5 P31644 1/20 0.39
GABRB2 P47870 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
ABCC4 O15439 1/20 0.38
CNR1 P21554 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NOS1 P29475 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
USP2 O75604 1/20 0.33

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
SCHEMBL27807523 1.00 MAPT (0.44) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL6278540 0.84 ALDH1A1 (0.45) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL5907164 0.84 ALDH1A1 (0.45) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL1405818 0.84 MAPT (0.45) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL9615934 0.84 MAPT (0.45) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL1405817 0.84 MAPT (0.45) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL4003166 0.83 MAPT (0.44) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL1387512 0.83 MAPT (0.44) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL8057318 0.83 MAPT (0.44) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL16230542 0.83 MAPT (0.47) MAPTALDH1A1MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102050831-B Cephalosporin derivative KBP BIOSCIENCES CO LTD 2014-02-26 CN disclosed
CN-102040615-B Cephalosporin antibiotics containing dihydropyrrolocycloalkyl KBP BIOSCIENCES CO LTD 2012-12-26 CN disclosed
CN-102070655-B Imidazole ring-containing cephalosporin derivative KBP BIOSCIENCES CO LTD 2012-09-26 CN disclosed
CN-102030766-B Cephalosporin antibiotics containing dihydropyrroloheterocycles SHANDONG XUANZHU MEDICAL TECHNOLOGY CO LTD 2012-08-08 CN disclosed
CN-101798315-B Cephalosporin derivative containing aza-cyclopropane nitrogen heterocyclic ring KBP BIOSCIENCES CO LTD 2012-07-04 CN disclosed
CN-101899059-B Pyrrolidine-containing tricyclic cephalosporin derivatives XUANZHU PHARMA CO.,LTD. (CN) 2012-02-15 CN disclosed
CN-101759710-B Cephalosporin derivatives containing substituted nitrogen heterocycles SHANDONG XUANZHU PHARM TECH CO 2011-10-05 CN disclosed
CN-102070655-A Imidazole ring-containing cephalosporin derivative SHANDONG XUANZHU MEDICAL TECHNOLOGY CO LTD 2011-05-25 CN disclosed
CN-102070656-A Substituted imidazole ring-containing cephalosporin derivatives SHANDONG XUANZHU MEDICAL TECHNOLOGY CO LTD 2011-05-25 CN disclosed
CN-102040615-A Cephalosporin antibiotics containing dihydropyrrolocycloalkyl SHANDONG XUANZHU MEDICAL SCI TECH CO LTD 2011-05-04 CN disclosed
CN-102030766-A Cephalosporin antibiotics containing dihydropyrroloheterocycles SHANDONG XUANZHU MEDICAL TECHNOLOGY CO LTD 2011-04-27 CN disclosed
CN-101899059-A Pyrrolidine-containing tricyclic cephalosporin derivatives KBP BIOSCIENCES CO LTD 2010-12-01 CN disclosed
CN-101798315-A Cephalosporin derivative containing aza-cyclopropane nitrogen heterocyclic ring SHANDONG XUANZHU PHARM TECH CO 2010-08-11 CN disclosed
CN-101781320-A Cephalosporin derivative containing pyridinium ions SHANDONG XUANZHU MEDICAL TECHN 2010-07-21 CN disclosed
CN-101759710-A Cephalosporin derivatives containing substituted nitrogen heterocycles SHANDONG XUANZHU PHARM TECH CO 2010-06-30 CN disclosed
CN-101712689-A Azepine condensed ring substituted cephalosporin derivative SHANDONG XUANZHU PHARM TECH CO 2010-05-26 CN disclosed
CN-101230070-A Novel anti-infection cephalosporin compounds ZHENHUA HUANG (CN) 2008-07-30 CN disclosed