SCHEMBL9075512

SCHEMBL9075512

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
PI4KB Q9UBF8 1/20 0.43
NPC1 O15118 4/20 0.42
RAB9A P51151 3/20 0.42
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 2/20 0.42
GAA P10253 1/20 0.41
PIK3CG P48736 1/20 0.41
CDK1 P06493 1/20 0.40
CDK4 P11802 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL9076364 0.85 CYP1A2 (0.37) SMN1; SMN2KMT2ACYP1A2CYP2C19MAPT
SCHEMBL9076267 0.85 MAPT (0.41) SMN1; SMN2KMT2ACYP1A2CYP2C19MAPT
SCHEMBL9076302 0.84 ALDH1A1 (0.49) SMN1; SMN2KMT2AL3MBTL1CYP1A2CYP2C19
SCHEMBL22017474 0.79 SMN1; SMN2 (0.46) SMN1; SMN2CYP1A2CYP2C19MAPTALDH1A1
SCHEMBL9073597 0.77 MAPT (0.43) SMN1; SMN2KMT2ACYP1A2CYP2C19MAPT
SCHEMBL4295980 0.76 L3MBTL1 (0.51) SMN1; SMN2KMT2AL3MBTL1CYP1A2MAPT
SCHEMBL12190585 0.75 L3MBTL1 (0.57) SMN1; SMN2KMT2AL3MBTL1CYP1A2MAPT
SCHEMBL4871149 0.74 CYP1A2 (0.76) SMN1; SMN2KMT2AL3MBTL1CYP1A2CYP2C19
SCHEMBL9074827 0.74 CYP1A2 (0.42) SMN1; SMN2CYP1A2CYP2C19MAPTALDH1A1
SCHEMBL963577 0.74 SMN1; SMN2 (0.55) SMN1; SMN2KMT2AMAPTALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5583216-A Methods for the manufacture of cephems TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-10 US disclosed
US-4973684-A Cephem compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-11-27 US disclosed
US-4912212-A Cephem compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-03-27 US disclosed
US-4668783-A Thiazolylacetamido cephalosporin compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-05-26 US disclosed
US-4514565-A Thiazolylacetamido cephalosphorin compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-04-30 US disclosed
US-4355160-A Thiazolylacetamido cephalosporin type compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-10-19 US disclosed
US-4298606-A Thiazolylacetamido compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-11-03 US disclosed
US-4205180-A CHEMICAL INTERMEDIATES FOR NOVEL CEPHALOSPORIN COMPOUNDS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1980-05-27 US disclosed
US-4203899-A Thiazolylacetamido compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1980-05-20 US disclosed
US-4098888-A THIAZOLYLACETAMIDO CEPHALOSPORIN TYPE COMPOUNDS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1978-07-04 US disclosed