SCHEMBL9020355

SCHEMBL9020355

CCOC(=O)c1cnn(CCOS(C)(=O)=O)c1N

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.56
LMNA P02545 2/20 0.56
ALDH1A1 P00352 5/20 0.52
RAB9A P51151 5/20 0.50
HPGD P15428 3/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TSHR P16473 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.48
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
MAPT P10636 2/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL1407148 0.84 NPC1 (0.61) NPC1LMNAALDH1A1RAB9AHPGD
SCHEMBL7105351 0.81 NPC1 (0.64) NPC1LMNAALDH1A1RAB9AHPGD
SCHEMBL9020337 0.80 CYP3A4 (0.51) NPC1LMNAALDH1A1RAB9AHPGD
SCHEMBL1406952 0.80 NPC1 (0.56) NPC1LMNAALDH1A1RAB9AHPGD
SCHEMBL173434 0.80 NPC1 (0.68) NPC1LMNAALDH1A1RAB9AHPGD
SCHEMBL1406981 0.80 NPC1 (0.58) NPC1LMNAALDH1A1RAB9AHPGD
SCHEMBL13766811 0.79 CYP3A4 (0.41) NPC1LMNAALDH1A1RAB9AHPGD
SCHEMBL8234400 0.78 TSHR (0.43) LMNAALDH1A1KDM4ETSHRSMN1; SMN2
SCHEMBL24452557 0.77 NPC1 (0.65) NPC1LMNAALDH1A1RAB9AHPGD
SCHEMBL18740310 0.76 MAPK1 (0.54) LMNAALDH1A1HPGDKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0332156-B1 Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1996-12-18 EP disclosed
US-5366970-A Cephem compounds and pharmaceutically acceptable salts thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-22 US disclosed
US-5173485-A Bactericides, microbiocides FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-12-22 US disclosed
EP-0332156-A2 Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-09-13 EP disclosed