SCHEMBL564729

SCHEMBL564729

NC(=O)c1ccc(O)nc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NNMT P40261 1/20 0.40
PARP1 P09874 3/20 0.37
IKBKB O14920 1/20 0.36
ERN1 O75460 1/20 0.36
KMT2A Q03164 3/20 0.35
ATM Q13315 1/20 0.35
SIRT3 Q9NTG7 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
DGAT1 O75907 1/20 0.35
PLK4 O00444 1/20 0.35
CHEK1 O14757 1/20 0.35
AURKA O14965 1/20 0.35
DAPK3 O43293 1/20 0.35
MAP4K4 O95819 1/20 0.35

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
SCHEMBL30733977 0.80 DGAT1 (0.42) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL975196 0.79 CYP1A2 (0.46) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL4883745 0.74 KDM4E (0.35) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL3633773 0.74 P2RX7 (0.40) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL6616377 0.72 BCAT2 (0.47) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL3632864 0.71 CASP1 (0.36) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL11583311 0.70 CHUK (0.37) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL3424158 0.69 ERN1 (0.54) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL30211643 0.69 ERN1 (0.54) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL7242650 0.69 NPC1 (0.49) KDM4EALDH1A1MAPTHPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112006967-A Anti-aging composition for cosmetics and preparation method thereof 张虎 2020-12-01 CN claimed
CN-116023654-A Resin for transparent copolymerized nylon film and film forming process thereof 中国石油化工股份有限公司 2023-04-28 CN disclosed
WO-2022178846-A1 REUSABLE MULTIFUNCTIONAL NANO-SURFACTANT AND PREPARATION METHOD THEREFOR 中国科学院生态环境研究中心 2022-09-01 WO disclosed
CN-112980595-B Recyclable multifunctional nano surfactant and preparation method thereof 中国科学院生态环境研究中心 2022-03-18 CN disclosed
CN-112980595-A Recyclable multifunctional nano surfactant and preparation method thereof 中国科学院生态环境研究中心 2021-06-18 CN disclosed
CN-112006967-A Anti-aging composition for cosmetics and preparation method thereof 张虎 2020-12-01 CN disclosed
US-9499570-B2 Boron containing small molecules ANACOR PHARMACEUTICALS, INC. (US) 2016-11-22 US disclosed
US-9499570-B2 Boron containing small molecules ANACOR PHARMACEUTICALS, INC. (US) 2016-11-22 US disclosed
US-9499570-B2 Boron containing small molecules ANACOR PHARMACEUTICALS, INC. (US) 2016-11-22 US disclosed
US-20150376210-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, LLC 2015-12-31 US disclosed
US-20120035132-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2012-02-09 US disclosed
US-20120035132-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2012-02-09 US disclosed
US-20120035132-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2012-02-09 US disclosed
WO-2011094450-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC (US) 2011-08-04 WO disclosed
WO-2011094450-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC (US) 2011-08-04 WO disclosed
WO-2000006547-A1 PROCESS FOR THE PREPARATION OF 2,6-DICHLORONICOTINONITRILES ASAHI GLASS COMPANY LTD. (JP) 2000-02-10 WO disclosed
US-5155113-A Administering 5-fluorouracil and derivatives with pyridine and pyridone derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-13 US disclosed
EP-0180188-B1 A COMPOSITION FOR INCREASING THE ANTI-CANCER ACTIVITY OF AN ANTI-CANCER COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 EP disclosed
EP-0180188-A2 A composition for increasing the anti-cancer activity of an anti-cancer compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed
US-4079052-A Diazopigments containing pyridine derivatives CIBA-GEIGY CORPORATION (US) 1978-03-14 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 (2 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-20120035132-A1 BORON-CONTAINING SMALL MOLECULES BTD, BCL6B, BBOX1 KDM4E 3959/4885ALDH1A1 3735/4885MAPT 2053/4885
US-20150376210-A1 BORON-CONTAINING SMALL MOLECULES BTD, BCL6B, BBOX1 KDM4E 3959/4885ALDH1A1 3735/4885MAPT 2053/4885

“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.