SCHEMBL6154342

SCHEMBL6154342

CCOc1ccc(C=[N+]([O-])C2CCCCC2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
APOBEC3G Q9HC16 1/20 0.46
AMY1A P0DUB6 2/20 0.45
IGF1R P08069 1/20 0.44
MAPT P10636 6/20 0.41
MEN1 O00255 3/20 0.41
LMNA P02545 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE3A Q14432 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALOX12 P18054 1/20 0.41
GAA P10253 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 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
SCHEMBL6154006 0.95 AMY1A (0.45) KMT2AALDH1A1HPGDAPOBEC3GAMY1A
SCHEMBL6154696 0.95 AMY1A (0.45) KMT2AALDH1A1HPGDAPOBEC3GAMY1A
SCHEMBL6153992 0.94 AMY1A (0.46) KMT2AALDH1A1HPGDAPOBEC3GAMY1A
SCHEMBL6155244 0.91 KMT2A (0.48) KMT2AALDH1A1HPGDAMY1AIGF1R
SCHEMBL6153956 0.88 AMY1A (0.45) KMT2AALDH1A1AMY1AIGF1RMAPT
SCHEMBL30128816 0.85 ALDH1A1 (0.51) KMT2AALDH1A1HPGDMAPTMEN1
SCHEMBL6155316 0.85 APP (0.53) KMT2AALDH1A1HPGDMAPTMEN1
SCHEMBL6154567 0.85 HPGD (0.42) KMT2AALDH1A1HPGDAPOBEC3GMAPT
SCHEMBL14993339 0.81 ALDH1A1 (0.50) KMT2AALDH1A1HPGDMAPTMEN1
SCHEMBL14993336 0.81 ALDH1A1 (0.50) KMT2AALDH1A1HPGDMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1025079-B1 $g(a)-ARYL-$i(N)-ALKYLNITRONES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME RENOVIS INC (US) 2005-02-02 EP claimed
US-20030087957-A1 Alpha-aryl-N-alkylnitrones and pharmaceutical compositions containing the same RENOVIS, INC. 2003-05-08 US claimed
US-20050124691-A1 Alpha-aryl-N-alkylnitrones and pharmaceutical compositions containing the same KELLEHER JUDITH A (US) 2005-06-09 US disclosed
EP-1025079-B1 $g(a)-ARYL-$i(N)-ALKYLNITRONES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME RENOVIS INC (US) 2005-02-02 EP disclosed
US-20030087957-A1 Alpha-aryl-N-alkylnitrones and pharmaceutical compositions containing the same RENOVIS, INC. 2003-05-08 US disclosed
US-6441032-B1 TREATING SYSTEMIC LUPIS AND MULTIPLE SCLEROSIS CENTAUR PHARMACEUTICALS, INC. 2002-08-27 US disclosed
US-6433008-B1 TREATING PARKINSON*S, ALZHEIMER*S, AUTOIMMUNE AND RHEUMATIC DISEASES; HUMAN IMMUNODEFICIENCY VIRUS (HIV) DEMENTIA, AND INFLAMMATION CENTAUR PHARMACEUTICALS, INC. 2002-08-13 US disclosed
US-6046232-A THERAPEUTICS FOR TREATING AND/OR PREVENTING NEUROLOGICAL, AUTOIMMUNE AND INFLAMMATORY CONDITIONS IN MAMMALS AND AS ANALYTICAL REAGENTS FOR DETECTING FREE RADICALS CENTAUR PHARMACEUTICALS, INC. (US) 2000-04-04 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-20050124691-A1 Alpha-aryl-N-alkylnitrones and pharmaceutical compositions containing the same NLN, NAT1, SNCA KMT2A 4081/4885ALDH1A1 410/4885HPGD 283/4885
US-20030087957-A1 Alpha-aryl-N-alkylnitrones and pharmaceutical compositions containing the same NLN, NAT1, SNCA KMT2A 3999/4885ALDH1A1 499/4885HPGD 277/4885

“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.