SCHEMBL9433307

SCHEMBL9433307

O=C1NC(=O)/C(=C/c2cccc(OCc3ccccc3)c2)S1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.81
PTPN1 P18031 5/20 0.79
HPGD P15428 5/20 0.79
POLB P06746 1/20 0.79
MAOA P21397 1/20 0.79
MAOB P27338 1/20 0.79
MMP13 P45452 2/20 0.79
ADAMTS5 Q9UNA0 2/20 0.79
AKR1B1 P15121 2/20 0.71
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
IGF1R P08069 1/20 0.66
MMP3 P08254 1/20 0.65
PIM1 P11309 1/20 0.65
PIM2 Q9P1W9 1/20 0.65

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
SCHEMBL1248797 1.00 CNR1 (0.81) CNR1PTPN1HPGDPOLBMAOA
SCHEMBL1248799 1.00 CNR1 (0.81) CNR1PTPN1HPGDPOLBMAOA
SCHEMBL8159450 0.93 HPGD (0.81) CNR1PTPN1HPGDPOLBMAOA
SCHEMBL8159449 0.93 HPGD (0.81) CNR1PTPN1HPGDPOLBMAOA
SCHEMBL8876624 0.89 HPGD (0.81) CNR1PTPN1HPGDPOLBMAOA
SCHEMBL8876632 0.89 HPGD (0.81) CNR1PTPN1HPGDPOLBMAOA
SCHEMBL15421510 0.89 HPGD (1.00) PTPN1HPGDPOLBMAOAMAOB
SCHEMBL934310 0.89 HPGD (1.00) PTPN1HPGDPOLBMAOAMAOB
SCHEMBL934311 0.89 HPGD (1.00) PTPN1HPGDPOLBMAOAMAOB
SCHEMBL8182329 0.88 MMP13 (0.65) CNR1PTPN1HPGDPOLBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160102065-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREOF PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2016-04-14 US claimed
US-9896421-B2 Compound having skin-whitening, anti-oxidizing and PPAR activities and medical use thereof PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2018-02-20 US disclosed
US-20160102065-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREOF PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2016-04-14 US disclosed
US-9216148-B2 Compound having skin-whitening, anti-oxidizing and PPAR activities and medical use therefor PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2015-12-22 US disclosed
US-20140023603-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2014-01-23 US disclosed
US-7879893-B2 Zinc binding ligand; sustained release of insulin NOVO NORDISK A/S (DK) 2011-02-01 US disclosed
US-7879893-B2 Zinc binding ligand; sustained release of insulin NOVO NORDISK A/S (DK) 2011-02-01 US disclosed
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 US disclosed
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 US disclosed
US-5326770-A Monoamine oxidase-B (MAO-B) inhibitory 5-substituted 2,4-thiazolidinediones useful in treating memory disorders of mammals THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-07-05 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-20140023603-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREFOR PPARG, PPARA, PPARD CNR1 2956/4885PTPN1 1719/4885HPGD 489/4885
US-20160102065-A1 NOVEL COMPOUND HAVING SKIN-WHITENING, ANTI-OXIDIZING AND PPAR ACTIVITIES AND MEDICAL USE THEREOF PPARG, PPARA, TYR CNR1 3252/4885PTPN1 1280/4885HPGD 681/4885
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB CNR1 4656/4885PTPN1 3178/4885HPGD 3478/4885

“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.