SCHEMBL447822

SCHEMBL447822

CC([C]=O)Sc1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HSD17B10 Q99714 2/20 0.49
EHMT2 Q96KQ7 1/20 0.47
EHMT1 Q9H9B1 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
ALDH1A1 P00352 6/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TSHR P16473 1/20 0.40
KDM4E B2RXH2 3/20 0.38
GAA P10253 2/20 0.38
USP2 O75604 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 1/20 0.36
ALOX15 P16050 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL236946 0.82 EHMT2 (0.53) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL10403068 0.81 EHMT2 (0.47) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL30495965 0.78 EHMT2 (0.56) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL9888690 0.78 EHMT2 (0.56) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL5061383 0.75 EHMT2 (0.52) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL9967715 0.75 EHMT2 (0.52) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL7818128 0.75 EHMT2 (0.52) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL7459671 0.75 EHMT2 (0.52) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL10403945 0.74 SMN1; SMN2 (0.49) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
Hydrochloric Acid SCHEMBL10706712 0.73 EHMT2 (0.50) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919941-B2 Functional lipid constructs KODE BIOTECH LIMITED (NZ) 2021-02-16 US disclosed
US-10082515-B2 Peptide-lipid constructs and their use in diagnostic and therapeutic applications KODE BIOTECH LIMITED (NZ) 2018-09-25 US disclosed
US-9802981-B2 Functional lipid constructs KODE BIOTECH LIMITED (NZ) 2017-10-31 US disclosed
US-20170218027-A1 FUNCTIONAL LIPID CONSTRUCTS KODE BIOTECH LIMITED (NZ) 2017-08-03 US disclosed
EP-2201025-B1 FUNCTIONAL LIPID CONSTRUCTS KODE BIOTECH LTD (NZ) 2016-04-20 EP disclosed
EP-2198301-B1 PEPTIDE-LIPID CONSTRUCTS AND THEIR USE IN DIAGNOSTIC AND THERAPEUTIC APPLICATIONS KODE BIOTECH LTD (NZ) 2015-04-08 EP disclosed
US-20140350217-A1 FUNCTIONAL LIPID CONSTRUCTS KODE BIOTECH LIMITED (NZ) 2014-11-27 US disclosed
US-8669084-B2 Functional lipid constructs KODE BIOTECH LIMITED (NZ) 2014-03-11 US disclosed
US-20130280746-A1 PEPTIDE-LIPID CONSTRUCTS AND THEIR USE IN DIAGNOSTIC AND THERAPEUTIC APPLICATIONS KODE BIOTECH LIMITED (NZ) 2013-10-24 US disclosed
US-8394594-B2 Peptide-lipid constructs and their use in diagnostic and therapeutic applications KODE BIOTECH LIMITED (NZ) 2013-03-12 US disclosed
US-7989446-B2 4-amino 5-cyanopyrimidine derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-08-02 US disclosed
US-20110171666-A1 PEPTIDE-LIPID CONSTRUCTS AND THEIR USE IN DIAGNOSTIC AND THERAPEUTIC APPLICATIONS KODE BIOTECH LIMITED (NZ) 2011-07-14 US disclosed
US-20110009620-A1 4-Amino-5-cyanopyrimidine derivatives OTSUKA PHARMACEUTICAL CO., LTD. 2011-01-13 US disclosed
US-7834002-B2 4-amino-5-cyanopyrimidine derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-11-16 US disclosed
US-20080182854-A1 4-Amino-5-Cyanopyrimidine Derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-07-31 US disclosed
EP-1740574-B1 4-AMINO-5-CYANOPYRIMIDINE DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2007-06-27 EP disclosed
EP-1740574-A2 4-AMINO-5-CYANOPYRIMIDINE DERIVATIVES Otsuka Pharmaceutical Company, Limited (JP) 2007-01-10 EP disclosed
WO-2005105778-A2 4-AMINO-5-CYANOPYRIMIDINE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-11-10 WO disclosed
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 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 (6 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-20110009620-A1 4-Amino-5-cyanopyrimidine derivatives ADORA2A, ADORA1, ADORA3 HPGD 781/4885SMN1; SMN2 4598/4885HSD17B10 3973/4885
US-20080182854-A1 4-Amino-5-Cyanopyrimidine Derivatives ADORA2A, ADORA1, ADORA3 HPGD 781/4885SMN1; SMN2 4598/4885HSD17B10 3973/4885
US-20170218027-A1 FUNCTIONAL LIPID CONSTRUCTS CETP, LCAT, LIPA HPGD 1854/4885SMN1; SMN2 4732/4885HSD17B10 500/4885
US-10919941-B2 Functional lipid constructs CETP, LCAT, LIPA HPGD 1854/4885SMN1; SMN2 4732/4885HSD17B10 500/4885
US-10082515-B2 Peptide-lipid constructs and their use in diagnostic and therapeutic applications PHOSPHO1, PTDSS2, PTDSS1 HPGD 4114/4885SMN1; SMN2 2702/4885HSD17B10 3014/4885
US-20140350217-A1 FUNCTIONAL LIPID CONSTRUCTS CETP, LCAT, SGMS1 HPGD 2096/4885SMN1; SMN2 4558/4885HSD17B10 779/4885

“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.