SCHEMBL1007130

SCHEMBL1007130

CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1CC

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.73
LMNA P02545 4/20 0.73
HPGD P15428 2/20 0.73
HSD17B10 Q99714 2/20 0.73
TSHR P16473 2/20 0.73
TP53 P04637 1/20 0.73
KDM4E B2RXH2 8/20 0.69
ADORA3 P0DMS8 3/20 0.65
GAA P10253 3/20 0.65
POLB P06746 1/20 0.65
HTT P42858 3/20 0.60
MAPT P10636 2/20 0.60
MEN1 O00255 1/20 0.58
ALOX15 P16050 1/20 0.58
KMT2A Q03164 1/20 0.58
MTOR P42345 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.54
ABCC1 P33527 1/20 0.53
CACNA1F O60840 1/20 0.51

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
SCHEMBL9672168 0.93 ALDH1A1 (0.65) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL5359112 0.86 GAA (0.59) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL10001053 0.85 ALDH1A1 (0.56) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL9139821 0.85 ALDH1A1 (1.00) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL10001054 0.84 ALDH1A1 (0.54) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL1663817 0.83 LMNA (0.87) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL15989535 0.82 ALDH1A1 (0.65) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL3503405 0.82 KDM4E (1.00) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL7152871 0.80 ALDH1A1 (0.78) ALDH1A1LMNAHPGDHSD17B10TSHR
SCHEMBL9831538 0.80 LMNA (0.71) ALDH1A1LMNAHPGDHSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6306203-B1 FOR USE IN INK JET PRINTING, INCLUDING PIEZOELECTRIC INK JET PRINTING AND ACOUSTIC INK JET PRINTING XEROX CORPORATION 2001-10-23 US claimed
US-4271260-A POSITIVE IMAGES OBTAINED USING A SUPPORTED LAYER OF AN ALKALI-SOLUBLE POLYMERIC BINDER, A HEXAARYLBIIMIAZOLE, AND A CARBOXY-, CARBONYL-, OR CYANO-SUBSTITUTED DIHYDROPYRIDINE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-06-02 US claimed
US-4243741-A HEXAARYLBIIMIDAZOLE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-01-06 US claimed
CN-110483563-B Preparation method and application of novel ionic beta-naphthoic aldehyde Schiff base zirconium complex 山西医科大学 2021-12-28 CN disclosed
EP-2842559-A2 Compounds, compositions and methods for the treatment of viral infections and other medical disorders Chimerix, Inc. (US) 2015-03-04 EP disclosed
EP-1868628-B1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF POXVIRUS INFECTIONS CHIMERIX INC (US) 2014-06-11 EP disclosed
US-8642577-B2 Compounds, compositions and methods for the treatment of poxvirus infections CHIMERIX, INC. (US) 2014-02-04 US disclosed
US-20110015149-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS AND OTHER MEDICAL DISORDERS CHIMERIX, INC. 2011-01-20 US disclosed
US-20070003608-A1 Compounds, compositions and methods for the treatment of viral infections and other medical disorders CHIMERIX, INC. 2007-01-04 US disclosed
US-20070003516-A1 Compounds, compositions and methods for the treatment of poxvirus infections EMERGENT BIODEFENSE OPERATIONS LANSING LLC 2007-01-04 US disclosed
EP-1007034-B1 COMPOSITIONS CONTAINING BERGAMOTTIN FOR INCREASING THE ORAL BIOAVAILABILITY OF PHARMACEUTICAL AGENTS WARNER LAMBERT CO (US) 2003-11-05 EP disclosed
WO-1999008676-A1 COMPOSITIONS CONTAINING BERGAMOTTIN FOR INCREASING THE ORAL BIOAVAILABILITY OF PHARMACEUTICAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-02-25 WO disclosed
US-5567592-A IDENTIFYING COMPOUNDS USEFUL FOR INCREASING BIOAVAILABILITY OF DRUG IN MAMMAL REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1996-10-22 US disclosed
US-5399458-A Process for making images employing a toner which has a tackiness that can be increased by actinic radiation E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-03-21 US disclosed
US-4716095-A PRETREATMENT WITH ACID E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-12-29 US disclosed
US-4698293-A Process for forming positive tonable images using a photosensitive material containing at least 1,4-dihydropyridine E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-10-06 US disclosed
EP-0224137-A2 Process for forming positive tonable images using a photosensitive material containing at least one 1,4-dihydropyridine E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-06-03 EP disclosed
US-4346162-A THIO COMPOUNDS IN NONSILVER PHOTGRAPHY E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-08-24 US disclosed
US-4292394-A Process for preparing multicolor toned images on a single photosensitive layer E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-09-29 US disclosed
US-4275140-A HAVING TACKY AREAS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-06-23 US 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 (3 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-20070003516-A1 Compounds, compositions and methods for the treatment of poxvirus infections IFNG, POLI, STING1 ALDH1A1 3014/4885LMNA 2309/4885HPGD 873/4885
US-20110015149-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS AND OTHER MEDICAL DISORDERS ACE, CYP27A1, LIPC ALDH1A1 857/4885LMNA 2125/4885HPGD 729/4885
US-20070003608-A1 Compounds, compositions and methods for the treatment of viral infections and other medical disorders ACE, CYP27A1, LIPC ALDH1A1 857/4885LMNA 2125/4885HPGD 729/4885

“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.