SCHEMBL4151561

SCHEMBL4151561

NC(=O)c1ccc(CO)o1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.67
ALDH1A1 P00352 6/20 0.53
TSHR P16473 2/20 0.53
CYP2C19 P33261 1/20 0.46
KDM4E B2RXH2 4/20 0.43
LMNA P02545 3/20 0.43
HPGD P15428 2/20 0.43
PRNP P04156 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HTT P42858 1/20 0.41
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 2/20 0.37

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
SCHEMBL4140757 0.83 TDP1 (0.45) TDP1ALDH1A1TSHRCYP2C19KDM4E
SCHEMBL24452452 0.83 TDP1 (0.67) TDP1ALDH1A1TSHRCYP2C19KDM4E
SCHEMBL3297500 0.81 NPC1 (0.46) TDP1ALDH1A1KDM4ELMNAHPGD
SCHEMBL19801525 0.81 TDP1 (0.44) TDP1ALDH1A1TSHRKDM4ELMNA
SCHEMBL29041312 0.80 MAPT (0.49) TDP1ALDH1A1TSHRKDM4ELMNA
Sumiki'S Acid SCHEMBL50822 0.80 TDP1 (1.00) TDP1ALDH1A1TSHRHSD17B10HTT
Sumiki'S Acid SCHEMBL29706392 0.80 TDP1 (1.00) TDP1ALDH1A1TSHRHSD17B10HTT
SCHEMBL6447185 0.80 TDP1 (0.69) TDP1ALDH1A1TSHRCYP2C19KDM4E
SCHEMBL28791562 0.79 TDP1 (0.58) TDP1ALDH1A1TSHRCYP2C19KDM4E
SCHEMBL21525922 0.78 TDP1 (0.67) TDP1ALDH1A1TSHRCYP2C19KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016068712-A1 CRYSTALLIZATION OF FURANIC COMPOUNDS NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2016-05-06 WO claimed
EP-4077446-B1 POLYIMINES AND USES THEREOF BOSTIK SA (FR) 2023-08-23 EP disclosed
US-11066398-B2 Small molecule c-Myc inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2021-07-20 US disclosed
CN-110177777-A For producing the method for containing at least two the aromatic compound of amine functional group 罗地亚经营管理公司 2019-08-27 CN disclosed
CN-106456616-A Small molecule C-Myc inhibitors 斯克利普斯研究院 2017-02-22 CN disclosed
EP-3082812-A1 SMALL MOLECULE C-MYC INHIBITORS The Scripps Research Institute (US) 2016-10-26 EP disclosed
US-20160264560-A1 SMALL MOLECULE C-MYC INHIBITORS SORRENTO THERAPEUTICS, INC. 2016-09-15 US disclosed
WO-2016068712-A1 CRYSTALLIZATION OF FURANIC COMPOUNDS NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2016-05-06 WO disclosed
EP-3015463-A1 Crystallization of furanic compounds Nederlandse Organisatie voor toegepast- natuurwetenschappelijk onderzoek TNO (NL) 2016-05-04 EP disclosed
WO-2015089180-A1 SMALL MOLECULE C-MYC INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2015-06-18 WO disclosed
EP-2762470-A1 Conversion of carbohydrates to hydroxymethylfurfural (HMF) and derivatives Archer-Daniels-Midland Company (US) 2014-08-06 EP disclosed
EP-1697354-B1 ISOTHIAZOLE DIOXIDES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS MERCK SHARP & DOHME (US) 2013-08-07 EP disclosed
US-20090054397-A1 PYRAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE COMPOUND OHI NORIHITO 2009-02-26 US disclosed
US-7429609-B2 Pyrazole compound and medicinal composition containing the same EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-09-30 US disclosed
US-20050208582-A1 Pyrazole compounds and pharmaceutical compositions comprising the compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-09-22 US disclosed
EP-1510516-A1 PYRAZOLE COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME Eisai Co., Ltd. (JP) 2005-03-02 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 (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-20090054397-A1 PYRAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE COMPOUND CNKSR1, NR3C2, CSNK2B TDP1 4520/4885ALDH1A1 2731/4885TSHR 814/4885
US-20160264560-A1 SMALL MOLECULE C-MYC INHIBITORS MYC, MYCBP, MYCBP2 TDP1 4024/4885ALDH1A1 3976/4885TSHR 4300/4885
US-11066398-B2 Small molecule c-Myc inhibitors MYC, MYCBP, MYCBP2 TDP1 4024/4885ALDH1A1 3976/4885TSHR 4300/4885

“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.