SCHEMBL3680667

SCHEMBL3680667

N#Cc1cn(Cc2ccco2)c(=O)[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TSHR P16473 5/20 0.42
GAA P10253 4/20 0.41
KDM4E B2RXH2 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
MEN1 O00255 4/20 0.41
POLB P06746 3/20 0.41
HTT P42858 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 4/20 0.40
MAPT P10636 3/20 0.40
HSD17B10 Q99714 2/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
RECQL P46063 1/20 0.40
HBB P68871 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL14307075 0.86 TSHR (0.42) KMT2ATSHRGAAKDM4EL3MBTL1
SCHEMBL7830017 0.79 MAPK1 (0.61) TSHRGAAKDM4EHPGDMAPK1
SCHEMBL7834032 0.77 SMN1; SMN2 (0.64) KMT2ASMN1; SMN2TSHRGAAKDM4E
SCHEMBL14231942 0.71 SMN1; SMN2 (0.58) KMT2ASMN1; SMN2KDM4EMEN1HTT
SCHEMBL11840596 0.70 CRHBP (0.48) KMT2ATSHRGAAKDM4EL3MBTL1
SCHEMBL7830417 0.70 L3MBTL1 (0.64) KMT2ASMN1; SMN2TSHRKDM4EL3MBTL1
SCHEMBL11708542 0.68 KMT2A (0.68) KMT2ASMN1; SMN2GAAKDM4EL3MBTL1
SCHEMBL2248519 0.68 KMT2A (0.52) KMT2ASMN1; SMN2GAAKDM4EL3MBTL1
SCHEMBL4167785 0.68 KDM4E (0.48) KMT2ASMN1; SMN2TSHRGAAKDM4E
SCHEMBL3571705 0.67 KMT2A (0.51) KMT2ASMN1; SMN2GAAKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100104644-A1 Compositions and Methods for Treating or Preventing Ophthalmic Disease UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-04-29 US claimed
US-20090291919-A1 Compositions and Methods for Treating or Preventing Ophthalmic Light Toxicity UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-11-26 US claimed
US-20090286808-A1 Opsin Stabilizing Compounds and Methods of Use UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-11-19 US claimed
EP-2069390-A2 OPSIN STABILIZING COMPOUNDS AND METHODS OF USE University of Florida Research Foundation, Inc. (US) 2009-06-17 EP claimed
EP-2069391-A2 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING OPHTHALMIC DISEASE University of Florida Research Foundation, Inc. (US) 2009-06-17 EP claimed
WO-2008013984-A2 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING OPHTHALMIC DISEASE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-01-31 WO claimed
WO-2008013983-A2 OPSIN STABILIZING COMPOUNDS AND METHODS OF USE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-01-31 WO claimed
US-20100104644-A1 Compositions and Methods for Treating or Preventing Ophthalmic Disease UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-04-29 US disclosed
US-20100104644-A1 Compositions and Methods for Treating or Preventing Ophthalmic Disease UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-04-29 US disclosed
US-20100104644-A1 Compositions and Methods for Treating or Preventing Ophthalmic Disease UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-04-29 US disclosed
US-20090291919-A1 Compositions and Methods for Treating or Preventing Ophthalmic Light Toxicity UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-11-26 US disclosed
US-20090291919-A1 Compositions and Methods for Treating or Preventing Ophthalmic Light Toxicity UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-11-26 US disclosed
US-20090291919-A1 Compositions and Methods for Treating or Preventing Ophthalmic Light Toxicity UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-11-26 US disclosed
US-20090286808-A1 Opsin Stabilizing Compounds and Methods of Use UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-11-19 US disclosed
EP-2069390-A2 OPSIN STABILIZING COMPOUNDS AND METHODS OF USE University of Florida Research Foundation, Inc. (US) 2009-06-17 EP disclosed
EP-2069391-A2 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING OPHTHALMIC DISEASE University of Florida Research Foundation, Inc. (US) 2009-06-17 EP disclosed
WO-2008013984-A2 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING OPHTHALMIC DISEASE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-01-31 WO disclosed
WO-2008013984-A2 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING OPHTHALMIC DISEASE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-01-31 WO disclosed
WO-2008013986-A2 COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING OPHTHALMIC LIGHT TOXICITY UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-01-31 WO disclosed
WO-2008013983-A2 OPSIN STABILIZING COMPOUNDS AND METHODS OF USE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-01-31 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 (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-20090291919-A1 Compositions and Methods for Treating or Preventing Ophthalmic Light Toxicity ALDH1A2, EYA3, PDE6C KMT2A 4649/4885SMN1; SMN2 4664/4885TSHR 3309/4885
US-20100104644-A1 Compositions and Methods for Treating or Preventing Ophthalmic Disease ALDH1A2, PDE6C, EYA3 KMT2A 4691/4885SMN1; SMN2 3321/4885TSHR 4547/4885
US-20090286808-A1 Opsin Stabilizing Compounds and Methods of Use CRYZ, NR2E3, CRYAB KMT2A 4623/4885SMN1; SMN2 231/4885TSHR 2400/4885

“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.