SCHEMBL368155

SCHEMBL368155

CC(=O)c1ccc(N2C(=O)CCC2=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.69
CA1 P00915 2/20 0.69
CA9 Q16790 2/20 0.69
GLA P06280 1/20 0.61
ADAM17 P78536 1/20 0.58
KMT2A Q03164 6/20 0.56
ATM Q13315 1/20 0.54
POLB P06746 2/20 0.53
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
LMNA P02545 1/20 0.49
CA2 P00918 1/20 0.47

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
SCHEMBL458085 0.82 CA12 (1.00) CA12CA1CA9GLAKMT2A
SCHEMBL11114613 0.80 ADAM17 (0.48) CA12CA1CA9GLAADAM17
SCHEMBL27893066 0.80 CA12 (0.69) CA12CA1CA9GLAKMT2A
SCHEMBL11478927 0.80 CA12 (0.67) CA12CA1CA9GLAKMT2A
SCHEMBL2951693 0.79 ALDH1A1 (0.63) CA12CA1CA9GLAKMT2A
SCHEMBL10082605 0.78 ALDH1A1 (0.60) CA1CA9KMT2APOLBMEN1
SCHEMBL16925630 0.78 CA9 (0.56) CA12CA1CA9GLAKMT2A
SCHEMBL371252 0.78 DDAH1 (0.68) ADAM17KMT2AALDH1A1
SCHEMBL25676620 0.77 ALDH1A1 (0.59) ADAM17KMT2AALDH1A1L3MBTL1NPC1
SCHEMBL12261669 0.77 CA12 (0.70) CA12CA1CA9GLAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115583902-B Preparation method of alkynyl thioether compound 江苏医药职业学院 2024-02-13 CN disclosed
CN-115583902-A Preparation method of alkynyl thioether compound 江苏医药职业学院 2023-01-10 CN disclosed
EP-2261696-B1 Copolymerizable azo compounds and articles containing them ABBOTT MEDICAL OPTICS INC (US) 2012-03-14 EP disclosed
US-7994135-B2 Monomethylvaline compounds capable of conjugation to ligands SEATTLE GENETICS, INC. (US) 2011-08-09 US disclosed
US-7807670-B2 Inhibitors of papilloma virus BOEHRINGER INGELHEIM CANADA LTD. (CA) 2010-10-05 US disclosed
US-7807670-B2 Inhibitors of papilloma virus BOEHRINGER INGELHEIM CANADA LTD. (CA) 2010-10-05 US disclosed
US-20100041649-A1 INHIBITORS OF PAPILLOMA VIRUS YOAKIM CHRISTIANE 2010-02-18 US disclosed
US-20100041649-A1 INHIBITORS OF PAPILLOMA VIRUS YOAKIM CHRISTIANE 2010-02-18 US disclosed
US-7528167-B2 Inhibitors of papilloma virus BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2009-05-05 US disclosed
US-20090047296-A1 Antibodies conjugated to Auristatin analogs via a maleimidocaproyl lingages; for treating cancer, autoimmune diseases and infectious diseases SEATTLE GENETICS, INC. (US) 2009-02-19 US disclosed
US-7326423-B2 Copolymerizable azo compounds and articles containing them ADVANCED MEDICAL OPTICS, INC. (US) 2008-02-05 US disclosed
US-7326423-B2 Copolymerizable azo compounds and articles containing them ADVANCED MEDICAL OPTICS, INC. (US) 2008-02-05 US disclosed
EP-1345943-B1 INHIBITORS OF PAPILLOMA VIRUS BOEHRINGER INGELHEIM CA LTD (CA) 2007-03-21 EP disclosed
WO-1992017516-A1 PROCESS FOR CURING POLYQUINOLINE POLYMERS AND COMPOSITIONS THEREOF MAXDEM INCORPORATED (US) 1992-10-15 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 (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-20090047296-A1 Antibodies conjugated to Auristatin analogs via a maleimidocaproyl lingages; for treating cancer, autoimmune diseases and infectious diseases MMAB, CAD, TRIM59 CA12 1279/4885CA1 1750/4885CA9 2039/4885
US-20100041649-A1 INHIBITORS OF PAPILLOMA VIRUS REV1, CDKN1A, RB1 CA12 1783/4885CA1 1965/4885CA9 1541/4885

“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.