SCHEMBL1593598

SCHEMBL1593598

CCOc1ccccc1-n1c(CN2CCCN(C)CC2)nc2ccccc2c1=O

nearest known ligand 0.92

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 14/20 0.92
ALDH1A1 P00352 3/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
LMNA P02545 1/20 0.65
PKM P14618 1/20 0.65
TSHR P16473 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
HTR7 P34969 3/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL12610265 0.96 HIF1A (1.00) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL4522145 0.90 HIF1A (0.75) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL1593340 0.90 HIF1A (0.75) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL1593540 0.89 HIF1A (0.74) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL12610042 0.89 HIF1A (0.86) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL4527044 0.88 HIF1A (0.72) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL14303700 0.87 HIF1A (0.83) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL1593685 0.87 HIF1A (0.70) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL12703792 0.86 HIF1A (0.69) HIF1AALDH1A1SMN1; SMN2LMNAPKM
SCHEMBL12610116 0.86 HIF1A (1.00) HIF1AALDH1A1SMN1; SMN2LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240207270-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING LIPID METABOLISM WAVEBREAK INC (US) 2024-06-27 US disclosed
US-20240207270-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING LIPID METABOLISM WAVEBREAK INC (US) 2024-06-27 US disclosed
US-20160271133-A1 Methods of Treating Multiple Myeloma and Resistant Cancers PROLEXYS PHARMACEUTICALS INC (US) 2016-09-22 US disclosed
US-20160271133-A1 Methods of Treating Multiple Myeloma and Resistant Cancers PROLEXYS PHARMACEUTICALS INC (US) 2016-09-22 US disclosed
US-20160015710-A1 Methods of Treating Multiple Myeloma and Resistant Cancers PROLEXYS PHARMACEUTICALS INC (US) 2016-01-21 US disclosed
US-20160015710-A1 Methods of Treating Multiple Myeloma and Resistant Cancers PROLEXYS PHARMACEUTICALS INC (US) 2016-01-21 US disclosed
US-20140227221-A1 METHODS OF TREATING MULTIPLE MYELOMA AND RESISTANT CANCERS PROLEXYS PHARMACEUTICALS, INC. (US) 2014-08-14 US disclosed
US-20140227221-A1 METHODS OF TREATING MULTIPLE MYELOMA AND RESISTANT CANCERS PROLEXYS PHARMACEUTICALS, INC. (US) 2014-08-14 US disclosed
US-8575143-B2 3-aryl-substituted quinazolones, and uses thereof PROLEXYS PHARMACEUTICALS, INC. (US) 2013-11-05 US disclosed
US-8518959-B2 Quinoxaline derivatives as antitumor agents PROLEXYS PHARMACEUTICALS, INC. (US) 2013-08-27 US disclosed
US-7615554-B2 Erastin and erastin binding proteins, and uses thereof PROLEXYS PHARMACEUTICALS, INC. (US) 2009-11-10 US disclosed
US-20090214465-A1 Quinoxaline Derivatives as Antitumor Agents PROLEXYS PHARMACEUTICALS, INC. (US) 2009-08-27 US disclosed
US-20090214465-A1 Quinoxaline Derivatives as Antitumor Agents PROLEXYS PHARMACEUTICALS, INC. (US) 2009-08-27 US disclosed
WO-2009002553-A1 METHODS OF TREATING MULTIPLE MYELOMA AND RESISTANT CANCERS PROLEXYS PHARMACEUTICALS, INC. (US) 2008-12-31 WO disclosed
EP-1999116-A2 3-ARYL-SUBSTITUTED QUINAZOLONES, AND USES THEREOF Prolexys Pharmaceuticals, Inc. (US) 2008-12-10 EP disclosed
WO-2008013987-A2 N-ALKYL SUBSTITUTED PIPERAZINYLMETHYLQUINAZOLINONES AND AZEPANYLMETHYLQUINAZOLINONES PROLEXYS PHARMACEUTICALS, INC. (US) 2008-01-31 WO disclosed
WO-2008013840-A2 ERASTIN ANALOGS AND USES THEREOF TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2008-01-31 WO disclosed
US-20070161644-A1 Erastin analogs and uses thereof STOCKWELL BRENT R 2007-07-12 US disclosed
US-20070161644-A1 Erastin analogs and uses thereof STOCKWELL BRENT R 2007-07-12 US disclosed
WO-2007076087-A2 3-ARYL-SUBSTITUTED QUINAZOLONES, AND USES THEREOF PROLEXYS PHARMACEUTICALS, INC. (US) 2007-07-05 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 (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-20160271133-A1 Methods of Treating Multiple Myeloma and Resistant Cancers MCL1, SLC11A2, MEN1 HIF1A 214/4885ALDH1A1 3199/4885SMN1; SMN2 1948/4885
US-20070161644-A1 Erastin analogs and uses thereof ERAP2, ERAP1, ERAL1 HIF1A 928/4885ALDH1A1 1049/4885SMN1; SMN2 1759/4885
US-20140227221-A1 METHODS OF TREATING MULTIPLE MYELOMA AND RESISTANT CANCERS MCL1, BCL3, DDIT3 HIF1A 275/4885ALDH1A1 1600/4885SMN1; SMN2 2093/4885
US-20160015710-A1 Methods of Treating Multiple Myeloma and Resistant Cancers MCL1, SLC11A2, MEN1 HIF1A 214/4885ALDH1A1 3199/4885SMN1; SMN2 1948/4885
US-20240207270-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING LIPID METABOLISM CPT2, PC, SREBF2 HIF1A 726/4885ALDH1A1 2857/4885SMN1; SMN2 4247/4885
US-20090214465-A1 Quinoxaline Derivatives as Antitumor Agents VDAC3, VDAC2, VDAC1 HIF1A 2396/4885ALDH1A1 4035/4885SMN1; SMN2 4765/4885

“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.