SCHEMBL5167397

SCHEMBL5167397

COC(=O)NC(C)(CO)CCc1cccs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.40
RIPK1 Q13546 1/20 0.40
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
SMN1; SMN2 Q16637 5/20 0.40
CTSK P43235 2/20 0.39
CTSS P25774 1/20 0.39
CTSC P53634 1/20 0.38
HPGD P15428 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
GAA P10253 1/20 0.37
POLB P06746 2/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
MEN1 O00255 1/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 1/20 0.37
CTDSP1 Q9GZU7 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
SCHEMBL5168621 0.77 L3MBTL1 (0.34) HPGDGAAKMT2AL3MBTL1
SCHEMBL5166904 0.77 TRPM8 (0.41) BRD4RIPK1NPC1RAB9ASMN1; SMN2
SCHEMBL9716502 0.73 RIPK1 (0.46) BRD4RIPK1NPC1RAB9ASMN1; SMN2
SCHEMBL6184762 0.70 NPC1 (0.56) BRD4NPC1RAB9ASMN1; SMN2CTSK
SCHEMBL27812443 0.70 GAA (0.44) BRD4RIPK1NPC1RAB9ASMN1; SMN2
SCHEMBL27843285 0.70 RIPK1 (0.51) RIPK1NPC1RAB9ASMN1; SMN2CTSC
SCHEMBL4473902 0.70 RIPK1 (0.51) RIPK1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4341638 0.70 RIPK1 (0.48) BRD4RIPK1NPC1RAB9ASMN1; SMN2
SCHEMBL4461404 0.70 SMN1; SMN2 (0.51) BRD4NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL4476863 0.69 TAAR1 (0.50) RIPK1NPC1RAB9ASMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300405-B1 AMINO ALCOHOL DERIVATIVES SANKYO CO (JP) 2007-04-18 EP disclosed
US-6964976-B2 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2005-11-15 US disclosed
US-20040132784-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-08 US disclosed
US-6723745-B2 PREVENTION OR TREATMENT OF AUTOIMMUNE DISEASE IN WARM BLOODED ANIMAL SANKYO COMPANY, LIMITED (JP) 2004-04-20 US disclosed
US-20030236297-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2003-12-25 US disclosed
EP-1300405-A1 AMINO ALCOHOL DERIVATIVES Sankyo Company, Limited (JP) 2003-04-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030236297-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A BRD4 980/4885RIPK1 3972/4885NPC1 3349/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A BRD4 980/4885RIPK1 3972/4885NPC1 3349/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.