SCHEMBL9523478

SCHEMBL9523478

COC(=O)Cn1ccccc1=S

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GAA P10253 2/20 0.47
POLB P06746 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 4/20 0.42
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.40
EGFR P00533 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
SCHEMBL7095748 0.81 KDM4E (0.53) KDM4ESMN1; SMN2GAAPOLBKMT2A
SCHEMBL10815571 0.78 KMT2A (0.51) KDM4EKMT2ATSHRMEN1
SCHEMBL10813398 0.77 ESR1 (0.42) KDM4ESMN1; SMN2CYP2C19KMT2ATSHR
SCHEMBL10696541 0.76 CRHBP (0.43) KDM4ECYP2C19KMT2AMEN1
SCHEMBL28590805 0.75 KDM4E (0.46) KDM4ESMN1; SMN2GAAPOLBCYP1A2
SCHEMBL1664069 0.72 MEN1 (0.46) KDM4ESMN1; SMN2GAAPOLBKMT2A
SCHEMBL17113282 0.71 KDM4E (0.42) KDM4ESMN1; SMN2GAAPOLBKMT2A
SCHEMBL9609770 0.71 KDM4E (0.50) KDM4ESMN1; SMN2GAAPOLBKMT2A
SCHEMBL28625554 0.71 ALDH1A1 (0.50) KDM4ESMN1; SMN2GAAPOLBCYP1A2
SCHEMBL8102665 0.71 KDM4E (0.50) KDM4ESMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0112987-B1 IMIDAZOLYLALKYLTHIENYL-TETRAHYDROPYRIDAZINES AND PROCESS FOR THEIR PREPARATION A. Nattermann & Cie. GmbH (DE) 1987-04-01 EP claimed
EP-0282365-B1 1-DETHIA-2-THIA-CEPHALOSPORANIC-ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AS THERAPEUTIC AGENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1993-05-12 EP disclosed
US-4908359-A Pharmaceuticals Uclaf, Roussel (FR) 1990-03-13 US disclosed
EP-0282365-A1 1-Dethia-2-thia-cephalosporanic-acid derivatives, process for their preparation, their use as therapeutic agents and pharmaceutical compositions containing them ROUSSEL-UCLAF (FR) 1988-09-14 EP disclosed
EP-0069872-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-10-28 EP disclosed
US-4495182-A TREATMENT OF INFECTIOUS DISEASES;CEPHALOSPORINS AND DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-01-22 US disclosed
EP-0069872-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-01-19 EP disclosed