SCHEMBL5166183

SCHEMBL5166183

CC(=O)NC(OC(C)=O)C(C)CCc1cccs1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
RAB9A P51151 4/20 0.43
CTSK P43235 5/20 0.42
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 2/20 0.38
ADAM17 P78536 1/20 0.38

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
SCHEMBL5166176 1.00 POLB (0.43) POLBRAB9ACTSKALDH1A1TSHR
SCHEMBL5166293 0.78 L3MBTL1 (0.36) POLBRAB9AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL6302938 0.75 NAAA (0.39) ALDH1A1PKMSMN1; SMN2KMT2AHPGD
SCHEMBL5168214 0.72 ACACB (0.33)
SCHEMBL5168562 0.71 CTSK (0.51) POLBRAB9ACTSKALDH1A1PKM
SCHEMBL13610024 0.70 POLB (0.44) POLBRAB9AALDH1A1TSHRPKM
SCHEMBL29242613 0.69 CYP2C19 (0.56) POLBRAB9ACTSKALDH1A1TSHR
SCHEMBL5168937 0.69 TAAR1 (0.48) POLBRAB9AKMT2AADAM17
SCHEMBL28744154 0.69 CYP2C19 (0.56) POLBRAB9AALDH1A1PKMNPC1
SCHEMBL11884441 0.69 CYP2C19 (0.47) POLBRAB9AALDH1A1L3MBTL1NPC1

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 POLB 2838/4885RAB9A 1895/4885CTSK 4419/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A POLB 2838/4885RAB9A 1895/4885CTSK 4419/4885

“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.