SCHEMBL1977830

SCHEMBL1977830

O=[N+]([O-])c1ncc(CO)[nH]1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
MAPK1 P28482 1/20 0.34
PKM P14618 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
RECQL P46063 1/20 0.32
PMP22 Q01453 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
FDPS P14324 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HRH1 P35367 1/20 0.31
HRH4 Q9H3N8 1/20 0.31

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
SCHEMBL5183476 0.86 TSHR (0.40) TSHRALDH1A1LMNATHRBMAPK1
SCHEMBL27003574 0.80 MAPT (0.35) TSHRALDH1A1LMNAMAPTKDM4E
SCHEMBL28871601 0.80 ALDH1A1 (0.33) TSHRALDH1A1LMNAMAPTRECQL
SCHEMBL27002842 0.78 HRH1 (0.33) TSHRALDH1A1LMNAMAPTHRH1
SCHEMBL10399826 0.73 GPR84 (0.46)
SCHEMBL18173529 0.73 HRH1 (0.45) HRH1HRH4
SCHEMBL10400086 0.72
SCHEMBL8185024 0.71 TSHR (0.49) TSHRALDH1A1PKMMAPTKDM4E
SCHEMBL4267930 0.70 MAPT (0.33) ALDH1A1MAPTKDM4EPOLBHTT
SCHEMBL12441774 0.70 MAPT (0.35) TSHRALDH1A1LMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113817164-B Hypoxic sensitive drug carrier polymer and preparation method and application thereof 北京化工大学 2022-11-29 CN claimed
CN-113817164-A Hypoxic sensitive drug carrier polymer and preparation method and application thereof 北京化工大学 2021-12-21 CN claimed
CN-113817164-B Hypoxic sensitive drug carrier polymer and preparation method and application thereof 北京化工大学 2022-11-29 CN disclosed
CN-113817164-A Hypoxic sensitive drug carrier polymer and preparation method and application thereof 北京化工大学 2021-12-21 CN disclosed
EP-2336141-B1 PHOSPHORAMIDATE ALKYLATOR PRODRUGS THRESHOLD PHARMACEUTICALS INC (US) 2016-03-30 EP disclosed
US-9226932-B2 Phosphoramidate alkylator prodrugs THRESHOLD PHARMACEUTICALS, INC. (US) 2016-01-05 US disclosed
US-20140170240-A1 Phosphoramidate Alkylator Prodrugs THRESHOLD PHARMACEUTICALS, INC. (US) 2014-06-19 US disclosed
US-8664204-B2 Phosphoramidate alkylator prodrugs THRESHOLD PHARMACEUTICALS, INC. (US) 2014-03-04 US disclosed
US-20130303778-A1 PHOSPHORAMIDATE ALKYLATOR PRODRUGS THRESHOLD PHARMACEUTICALS, INC. 2013-11-14 US disclosed
US-8507464-B2 Phosphoramidate alkylator prodrugs THRESHOLD PHARMACEUTICALS, INC. (US) 2013-08-13 US disclosed
US-20110251159-A1 Phosphoramidate Alkylator Prodrugs THRESHOLD PHARMACEUTICALS, INC. (US) 2011-10-13 US disclosed
US-20100137254-A1 PHOSPHORAMIDATE ALKYLATOR PRODRUGS IMMUNOGENESIS, INC. 2010-06-03 US disclosed
US-20100137254-A1 PHOSPHORAMIDATE ALKYLATOR PRODRUGS IMMUNOGENESIS, INC. 2010-06-03 US disclosed
US-20100137254-A1 PHOSPHORAMIDATE ALKYLATOR PRODRUGS IMMUNOGENESIS, INC. 2010-06-03 US disclosed
WO-2009033165-A1 HYPOXIA ACTIVATED PRODRUGS OF BIS-ALKYLATING AGENTS THRESHOLD PHARMACEUTICALS, INC. (US) 2009-03-12 WO disclosed
EP-1896040-A2 PHOSPHORAMIDATE ALKYLATOR PRODRUGS Threshold Pharmaceuticals, Inc. (US) 2008-03-12 EP disclosed
WO-2007002931-A2 PHOSPHORAMIDATE ALKYLATOR PRODRUGS THRESHOLD PHARMACEUTICALS, INC. (US) 2007-01-04 WO disclosed
EP-1173414-A1 N-PROTECTED AMINES AND THEIR USE AS PRODRUGS CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 2002-01-23 EP disclosed
WO-2000064864-A9 N-PROTECTED AMINES AND THEIR USE AS PRODRUGS CANCER RES CAMPAIGN TECH (GB) 2001-12-27 WO disclosed
WO-2000064864-A1 N-PROTECTED AMINES AND THEIR USE AS PRODRUGS CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 2000-11-02 WO 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 (4 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-20100137254-A1 PHOSPHORAMIDATE ALKYLATOR PRODRUGS TYMP, PAICS, PNP TSHR 2143/4885ALDH1A1 1886/4885LMNA 3316/4885
US-20110251159-A1 Phosphoramidate Alkylator Prodrugs TYMP, PAICS, PNP TSHR 2218/4885ALDH1A1 1961/4885LMNA 3521/4885
US-20140170240-A1 Phosphoramidate Alkylator Prodrugs TYMP, PAICS, PNP TSHR 2218/4885ALDH1A1 1961/4885LMNA 3521/4885
US-20130303778-A1 PHOSPHORAMIDATE ALKYLATOR PRODRUGS TYMP, PAICS, PNP TSHR 2218/4885ALDH1A1 1961/4885LMNA 3521/4885

“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.