Ceforanide

Ceforanide

SCHEMBL10760133

NCc1ccccc1CC(=O)NC1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CS[C@@H]12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Ceforanide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 10/20 1.00
HSD17B10 Q99714 4/20 1.00
LMNA P02545 3/20 1.00
KDM4E B2RXH2 2/20 1.00
MEN1 O00255 1/20 1.00
KMT2A Q03164 1/20 1.00
SLC6A4 P31645 1/20 0.61
SLC22A6 Q4U2R8 2/20 0.57
SLC22A8 Q8TCC7 2/20 0.57
SLC22A11 Q9NSA0 2/20 0.57
NR1I2 O75469 1/20 0.57
PGR P06401 1/20 0.57
PPARG P37231 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
POLB P06746 9/20 0.57
MAPT P10636 8/20 0.57
ALDH1A1 P00352 4/20 0.57
CTDSP1 Q9GZU7 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
PTGS2 P35354 1/20 0.51

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
Ceforanide SCHEMBL14303761 1.00 TDP1 (1.00) TDP1HSD17B10LMNAKDM4EMEN1
Ceforanide SCHEMBL10760121 1.00 TDP1 (1.00) TDP1HSD17B10LMNAKDM4EMEN1
Ceforanide SCHEMBL122072 1.00 TDP1 (1.00) TDP1HSD17B10LMNAKDM4EMEN1
Ceforanide SCHEMBL27820426 0.99 TDP1 (0.98) TDP1HSD17B10LMNAKDM4EMEN1
Ceforanide SCHEMBL28528800 0.99 TDP1 (0.98) TDP1HSD17B10LMNAKDM4EMEN1
Ceforanide SCHEMBL9390322 0.94 TDP1 (0.88) TDP1HSD17B10LMNAKDM4EMEN1
SCHEMBL11395464 0.93 TDP1 (0.88) TDP1HSD17B10LMNAKDM4EMEN1
Ceforanide SCHEMBL11668090 0.93 TDP1 (0.88) TDP1HSD17B10LMNAKDM4EMEN1
Ceforanide SCHEMBL9390332 0.93 TDP1 (0.87) TDP1HSD17B10LMNAKDM4EMEN1
Ceforanide SCHEMBL10764451 0.93 TDP1 (0.87) TDP1HSD17B10LMNAKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0106369-B1 PURIFICATION OF CEFORANIDE Bristol-Myers Company (US) 1987-08-12 EP claimed
EP-0106369-A2 Purification of ceforanide Bristol-Myers Company (US) 1984-04-25 EP claimed
EP-0106369-B1 PURIFICATION OF CEFORANIDE Bristol-Myers Company (US) 1987-08-12 EP disclosed
US-4448958-A SALT FORMATION WITH BENZYLDIMETHYLAMINE, DISSOLVING AND ADJUSTMENT OF PH TO CRYSTALLIZE BRISTOL-MYERS COMPANY (US) 1984-05-15 US disclosed
US-4448958-A SALT FORMATION WITH BENZYLDIMETHYLAMINE, DISSOLVING AND ADJUSTMENT OF PH TO CRYSTALLIZE BRISTOL-MYERS COMPANY (US) 1984-05-15 US disclosed