SCHEMBL2744787

SCHEMBL2744787

Brc1ccc(-c2ccon2)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.49
MAPT P10636 7/20 0.49
RAB9A P51151 5/20 0.49
NPC1 O15118 4/20 0.49
ALDH1A1 P00352 4/20 0.43
KMT2A Q03164 5/20 0.42
PLCG2 P16885 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
HSD17B10 Q99714 2/20 0.41
PPARG P37231 2/20 0.41
NCOA2 Q15596 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
NCOA1 Q15788 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
SNCA P37840 1/20 0.40
MEN1 O00255 3/20 0.39

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
SCHEMBL8286025 0.77 KDM4E (0.59) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL27634717 0.75 KDM4E (0.49) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL12621072 0.72 KDM4E (0.50) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL12568287 0.72 KDM4E (0.50) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL3082762 0.71 NPC1 (0.42) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL197157 0.71 SNCA (0.50) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL7944563 0.71 KDM4E (0.49) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL6262485 0.69 KDM4E (0.51) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL498474 0.69 SNCA (0.48) KDM4EMAPTRAB9ANPC1ALDH1A1
SCHEMBL5453288 0.69 SNCA (0.48) KDM4EMAPTRAB9ANPC1ALDH1A1

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178873-B2 Solution processable organic semiconductors 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-05-15 US disclosed
US-7868205-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2011-01-11 US disclosed
US-7868205-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2011-01-11 US disclosed
US-20100270542-A1 Solution Processable Organic Semiconductors 3M INNOVATIVE PROPERTIES COMPANY 2010-10-28 US disclosed
EP-2232606-A1 SOLUTION PROCESSABLE ORGANIC SEMICONDUCTORS BASED ON ANTHRACENE 3M Innovative Properties Company (US) 2010-09-29 EP disclosed
US-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 US disclosed
EP-2144893-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2010-01-20 EP disclosed
WO-2009079150-A1 SOLUTION PROCESSABLE ORGANIC SEMICONDUCTORS BASED ON ANTHRACENE 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-06-25 WO disclosed
US-7473790-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same PFIZER INC. (US) 2009-01-06 US disclosed
WO-2008137816-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-11-13 WO disclosed
EP-1171447-A2 KETOLIDE ANTIBACTERIALS Ortho-McNeil Pharmaceutical, Inc. (US) 2002-01-16 EP disclosed
EP-1171446-A2 MACROLIDE ANTIINFECTIVE AGENTS Kosan Biosciences, Inc. (US) 2002-01-16 EP disclosed
US-6147197-A INCREASED ACID STABILITY AND ENHANCED ACTIVITY TOWARD GRAM NEGATIVE BACTERIA AND MACROLIDE RESISTANT GRAM POSITIVE BACTERIA ABBVIE INC. 2000-11-14 US disclosed
WO-2000063224-A2 MACROLIDE ANTIINFECTIVE AGENTS KOSAN BIOSCIENCES, INC. (US) 2000-10-26 WO disclosed
WO-2000062783-A2 KETOLIDE ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2000-10-26 WO disclosed
US-6075133-A INCREASED ACID STABILITY AND ENHANCED BACTERICIDAL ACTIVITY ABBOTT LABORATORIES (US) 2000-06-13 US disclosed
US-6028181-A 6-0-Substituted antibacterial erythromycin ketolides and methods of making ABBOTT LABORATORIES (US) 2000-02-22 US disclosed
EP-0929563-A1 6-O-SUBSTITUTED KETOLIDES HAVING ANTIBACTERIAL ACTIVITY Abbott Laboratories (US) 1999-07-21 EP disclosed
US-5866549-A MACROLIDE ANTIBIOTICS ABBOTT LABORATORIES (US) 1999-02-02 US disclosed
WO-1998009978-A1 6-O-SUBSTITUTED KETOLIDES HAVING ANTIBACTERIAL ACTIVITY ABBOTT LABORATORIES (US) 1998-03-12 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-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS MMP13, MMP2, MMP12 KDM4E 1501/4885MAPT 3889/4885RAB9A 3446/4885

“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.