SCHEMBL6077657

SCHEMBL6077657

CC(C)CC1NC(=O)C2CSC(=O)N2C1=O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.45
LMNA P02545 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 2/20 0.37
PAX8 Q06710 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ABCG2 Q9UNQ0 2/20 0.35
CCR5 P51681 4/20 0.34
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
VDR P11473 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
SCHEMBL6076907 0.83 CYP2C9 (0.41) CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL6077888 0.81 MMP1 (0.35)
SCHEMBL6077284 0.77 KMT2A (0.40) GAAHTTMEN1KMT2AALDH1A1
SCHEMBL6078396 0.77 HDAC4 (0.40) LMNACYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL6078345 0.76 HDAC6 (0.35)
SCHEMBL6078844 0.75 ALDH1A1 (0.46) GAACYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL6077929 0.74 LMNA (0.37) GAALMNA
SCHEMBL6078148 0.74 NPSR1 (0.43) GAALMNAMEN1KMT2AABCG2
SCHEMBL10558628 0.73 GAA (0.39) GAALMNACYP3A4CYP2C9CYP2C19
SCHEMBL6077282 0.72 HDAC4 (0.30)

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
US-7022317-B2 Heterocyclic derivatives of 2-oxothiazolidine-4-carboxylic acid, and use as active photoprotective agents L'OREAL (FR) 2006-04-04 US claimed
US-20050129635-A1 Novel heterocyclic derivatives of 2-oxothiazolidine-4-carboxylic acid, and use as active photoprotective agents L'OREAL S.A. (FR) 2005-06-16 US claimed
EP-1471067-A1 Derivatives of 2-oxothiadiazoline-4-carboxylic acid and its use as active photoprotective agent L'OREAL (FR) 2004-10-27 EP claimed
US-7022317-B2 Heterocyclic derivatives of 2-oxothiazolidine-4-carboxylic acid, and use as active photoprotective agents L'OREAL (FR) 2006-04-04 US disclosed
US-20050129635-A1 Novel heterocyclic derivatives of 2-oxothiazolidine-4-carboxylic acid, and use as active photoprotective agents L'OREAL S.A. (FR) 2005-06-16 US disclosed
EP-1471067-A1 Derivatives of 2-oxothiadiazoline-4-carboxylic acid and its use as active photoprotective agent L'OREAL (FR) 2004-10-27 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 (1 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-20050129635-A1 Novel heterocyclic derivatives of 2-oxothiazolidine-4-carboxylic acid, and use as active photoprotective agents CUTA, OGDH, TYR GAA 1184/4885LMNA 3284/4885CYP3A4 443/4885

“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.