SCHEMBL743669

SCHEMBL743669

CCCCC[CH]c1ccccc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CA12 O43570 6/20 0.43
CA2 P00918 6/20 0.43
CA9 Q16790 5/20 0.43
TRIM24 O15164 1/20 0.42
TRIM33 Q9UPN9 1/20 0.42
IAPP P10997 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
ALOX12 P18054 1/20 0.41
MMP2 P08253 2/20 0.40

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
SCHEMBL10516475 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL3601328 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL3587145 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL3592730 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL3600856 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL3597535 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL4469886 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL3584638 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL3602229 0.98 CA12 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL9663811 0.94 MAPT (0.44) MAPTMEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2429292-A1 COMPOUNDS AND COMPOSITIONS COMPRISING CDK INHIBITORS AND METHODS FOR THE TREATMENT OF CANCER Georgia State University Research Foundation, Inc. (US) 2012-03-21 EP disclosed
WO-2010129858-A1 COMPOUNDS AND COMPOSITIONS COMPRISING CDK INHIBITORS AND METHODS FOR THE TREATMENT OF CANCER GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION (US) 2010-11-11 WO disclosed
US-7741242-B2 Prepared by crosslinking a homogenized an addition polymer containing units from an unsaturated aryl-containing glycidyl ether or ester and an unsaturated alcohol or carboxylic acid and a zero-valent Pd compound to physically deposit the Pd compound on the polymer; oxidizing alcohols to aldehydes WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2010-06-22 US disclosed
EP-2084196-A2 SHAPE MEMORY POLYMERS University of Rochester (US) 2009-08-05 EP disclosed
EP-1537913-B1 PALLADIUM CATALYST COMPOSITION WAKO PURE CHEMICAL INDUSTIES L (JP) 2009-07-01 EP disclosed
WO-2008051318-A2 SHAPE MEMORY POLYMERS UNIVERSITY OF ROCHESTER (US) 2008-05-02 WO disclosed
US-20060019822-A1 Palladium catalyst composition JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2006-01-26 US disclosed
EP-1537913-A1 PALLADIUM CATALYST COMPOSITION Wako Pure Chemical Industies, Ltd. (JP) 2005-06-08 EP disclosed
EP-0485026-A2 Antimanic phenoxymethylene bisphosphonate derivatives MERCK SHARP & DOHME LTD. (GB) 1992-05-13 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-20060019822-A1 Palladium catalyst composition ODC1, NUDC, ADH1C MAPT 3058/4885MEN1 2308/4885KMT2A 2594/4885

“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.