SCHEMBL6535050

SCHEMBL6535050

CC1=C(C)N(CC(=O)c2cccc(O)c2)CS1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.40
▸ GLA P06280 1/20 0.40
▸ CTNNB1 P35222 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA6 P23280 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ PARP1 P09874 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ EGLN2 Q96KS0 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ ALPL P05186 1/20 0.36
▸ ALPG P10696 1/20 0.36
▸ MGLL Q99685 1/20 0.36
▸ HSD17B1 P14061 2/20 0.35
▸ HSD17B2 P37059 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
Bromide SCHEMBL3845053 0.99 ALDH1A1 (0.42) ALDH1A1GLACTNNB1CA12CA1
Bromide SCHEMBL3849448 0.85 CA12 (0.36) ALDH1A1GLACA12CA1CA2
SCHEMBL1820216 0.84 ALDH1A1 (0.46) ALDH1A1CA12CA9KDM4ENPC1
Hydrochloric Acid SCHEMBL33828 0.83 RAB9A (0.46) ALDH1A1CA12CA9KDM4ENPC1
SCHEMBL6535470 0.83 PTPN1 (0.43) ALDH1A1KDM4ENPC1RAB9AMAPT
Bromide SCHEMBL2954276 0.83 ALDH1A1 (0.48) ALDH1A1CA12CA9KDM4ENPC1
SCHEMBL23535452 0.83 PTPN1 (0.50) ALDH1A1CA12CA1CA2CA9
Bromide SCHEMBL3845607 0.82 PTPN1 (0.42) ALDH1A1KDM4ENPC1RAB9AMAPT
Bromide SCHEMBL5004650 0.82 PTPN1 (0.42) ALDH1A1KDM4ENPC1RAB9AMAPT
Bromide SCHEMBL3848609 0.82 PTPN1 (0.49) ALDH1A1CA12CA1CA2CA9

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-1257272-A4 THIAZOLIUM COMPOUNDS AND TREATMENTS OF DISORDERS ASSOCIATED WITH PROTEIN AGING ALTEON INC (US) 2004-12-15 — — EP disclosed
EP-1257272-A1 THIAZOLIUM COMPOUNDS AND TREATMENTS OF DISORDERS ASSOCIATED WITH PROTEIN AGING Alteon, Inc. (US) 2002-11-20 — — EP disclosed
US-6458819-B1 INHIBITION OF FORMATION OF ADVANCED GLYCOSYLATION OF PROTEINS AND TO BREAKING THE CROSS-LINKS THAT FORM BETWEEN ADVANCED GLYCOSYLATION ENDPRODUCTS OR BETWEEN AGES AND OTHER PROTEINS. ALTEON, INC. 2002-10-01 — — US disclosed
US-20020055527-A1 Thiazolium compounds and treatments of disorders associated with protein aging SYNVISTA THERAPEUTICS, INC. 2002-05-09 — — US disclosed
WO-2001062250-A1 THIAZOLIUM COMPOUNDS AND TREATMENTS OF DISORDERS ASSOCIATED WITH PROTEIN AGING ALTEON, INC. (US) 2001-08-30 — — WO 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-20020055527-A1 Thiazolium compounds and treatments of disorders associated with protein aging TTR, RBP4, COL2A1 ALDH1A1 2756/4885GLA 18/4885CTNNB1 2311/4885

“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.

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