SCHEMBL7766255

SCHEMBL7766255

CC(=O)Oc1[c]ccc(N)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.39
LMNA P02545 2/20 0.34
CYP3A4 P08684 1/20 0.34
BACE1 P56817 1/20 0.34
ALDH1A1 P00352 3/20 0.33
GAA P10253 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HTT P42858 2/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TOP1 P11387 1/20 0.33
ABCB11 O95342 1/20 0.33
PREP P48147 2/20 0.33
CFD P00746 1/20 0.33
CELA1 Q9UNI1 1/20 0.33
CA2 P00918 1/20 0.32
NR3C1 P04150 1/20 0.32

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
SCHEMBL2079650 0.79 LMNA (0.47) LMNACYP3A4BACE1ALDH1A1GAA
SCHEMBL1451590 0.79 LMNA (0.47) LMNACYP3A4BACE1GAAKDM4E
SCHEMBL2077524 0.76 BACE1 (0.44) LMNACYP3A4BACE1ALDH1A1HTT
SCHEMBL2890991 0.74
SCHEMBL27568084 0.73 ELANE (0.53) LMNACYP3A4BACE1ALDH1A1KDM4E
SCHEMBL2079645 0.73 KDM4E (0.43) LMNAALDH1A1KDM4EMAPT
SCHEMBL6170690 0.71 ALDH1A1 (0.36) LMNACYP3A4ALDH1A1GAAKDM4E
SCHEMBL131380 0.71 KDM4E (0.41) LMNACYP3A4BACE1ALDH1A1GAA
SCHEMBL19947459 0.69 TUBB4A (0.46) CYP3A4BACE1ALDH1A1GAAKDM4E
SCHEMBL8135198 0.69 SRD5A2 (0.38) LMNAALDH1A1TSHRRAB9AMAPT

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 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0334590-B1 3-(Substituted)-1-carba(dethia)-3-cephems and cephalosporins and a process for production therefor LILLY CO ELI (US) 2001-07-04 EP disclosed
EP-0565351-B1 Process for preparing 7-substituted-amino-3-hydroxy-3-cephem-4-protected carboxy-sulfoxide esters LILLY CO ELI (US) 2000-08-23 EP disclosed
EP-0558215-B1 Novel methods and compounds for the preparation of carbacephems LILLY CO ELI (US) 1999-09-15 EP disclosed
US-5700933-A 3(2-OXAZOLIDINONE-3-YL)-2-AZETIDINONE-1-ACETIC ACID OR ESTER FOR MAKING CARBACEPHALOSPORINS ANTIBIOTICS ELI LILLY AND COMPANY (US) 1997-12-23 US disclosed
US-5644051-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1997-07-01 US disclosed
EP-0494118-B1 Process for 3-exomethylenecepham sulfoxide esters LILLY CO ELI (US) 1997-04-09 EP disclosed
US-5521307-A Methods and compounds for the preparation of carbacephems ELI LILLY AND COMPANY (US) 1996-05-28 US disclosed
US-5512454-A Enzymatic acylation of 3-hydroxymethyl cephalosporins BRISTOL-MYERS SQUIBB COMPANY (US) 1996-04-30 US disclosed
EP-0677523-A1 3-(substituted)-1-carba(dethia)-3-cephems and cephalosporins and a process for production therefor ELI LILLY AND COMPANY (US) 1995-10-18 EP disclosed
EP-0667396-A1 Enzymatic acylation of 3-hydroxymethyl cephalosporins BRISTOL-MYERS SQUIBB COMPANY (US) 1995-08-16 EP disclosed
US-4855418-A Process for production of ceophalosporins ELI LILLY AND COMPANY (US) 1989-08-08 US disclosed
EP-0324562-A1 1-Carba(dethia)-3-cephem derivatives ELI LILLY AND COMPANY (US) 1989-07-19 EP disclosed
US-4820832-A Process for preparing 3-unsubstituted cephalosporins and 1-carba(dethia)cephalosporins ELI LILLY AND COMPANY (US) 1989-04-11 US disclosed
US-4820816-A 3-trifuoromethylsulfonyloxy-substituted 1-carbacephalosporins as intermediates for antibiotics PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1989-04-11 US disclosed
EP-0299728-A2 Carbonylation process for beta-lactam antibiotics ELI LILLY AND COMPANY (US) 1989-01-18 EP disclosed
US-4791106-A 1-Carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1988-12-13 US disclosed
US-4778884-A REACTING TRIFLUOROMETHYLSULFONYLOXY COMPOUND WITH LITHIUM HALIDE IN APROTIC POLAR SOLVENT PRESIDENT & FELLOWS OF HARVARD COLLEGE (US) 1988-10-18 US disclosed
EP-0232623-A1 1-Carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1987-08-19 EP disclosed
US-4673737-A ANTIBIOTICS/ HARVARD UNIVERSITY (US) 1987-06-16 US disclosed
EP-0211540-A1 Intermediates and process for antibiotics THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1987-02-25 EP disclosed