SCHEMBL9075868

SCHEMBL9075868

CCOC(=O)CNc1csc(O)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ELANE P08246 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.40
PTGS2 P35354 1/20 0.39
GAA P10253 3/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TP53 P04637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL4840983 0.86 ALDH1A1 (0.43) ALDH1A1KDM4EMEN1KMT2AELANE
SCHEMBL9076762 0.84 ALDH1A1 (0.52) ALDH1A1KDM4EMEN1KMT2AELANE
SCHEMBL4810702 0.84 ALDH1A1 (0.41) ALDH1A1KDM4EMEN1KMT2AELANE
SCHEMBL4832424 0.74 TSHR (0.43) ALDH1A1KDM4EKMT2AELANEHTT
SCHEMBL9076268 0.73 MAPK1 (0.47) ALDH1A1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL11012092 0.73 MEN1 (0.66) ALDH1A1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL10780676 0.72 CCNA2 (0.30)
SCHEMBL31742478 0.72 ALDH1A1 (0.53) ALDH1A1KDM4EMEN1KMT2AHTT
SCHEMBL11704831 0.71 KDM4E (0.60) ALDH1A1KDM4EMEN1KMT2AELANE
SCHEMBL19208916 0.69 RAB9A (0.66) ALDH1A1KDM4EMEN1KMT2ASMN1; 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 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