SCHEMBL4887657

SCHEMBL4887657

O=C1Nc2ccccc2Oc2ccc([N+](=O)[O-])cc21

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.80
KMT2A Q03164 7/20 0.80
MEN1 O00255 6/20 0.80
POLB P06746 5/20 0.80
L3MBTL1 Q9Y468 3/20 0.80
ALDH1A1 P00352 2/20 0.80
SMN1; SMN2 Q16637 4/20 0.54
LMNA P02545 3/20 0.54
HTT P42858 3/20 0.54
TDP1 Q9NUW8 2/20 0.53
CYP3A4 P08684 1/20 0.53
CAPN9 O14815 1/20 0.52
CASP3 P42574 1/20 0.52
CHRM2 P08172 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
DRD1 P21728 1/20 0.47
PTGS1 P23219 1/20 0.47
SLC6A4 P31645 1/20 0.47
DRD3 P35462 1/20 0.47

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
SCHEMBL30181459 0.99 MAPT (0.78) MAPTKMT2AMEN1POLBL3MBTL1
Ammonia Solution, Strong SCHEMBL23835580 0.99 MAPT (0.78) MAPTKMT2AMEN1POLBL3MBTL1
SCHEMBL13437129 0.84 MAPT (0.57) MAPTKMT2AMEN1POLBL3MBTL1
SCHEMBL2113066 0.83 ALDH1A1 (0.56) MAPTKMT2AMEN1POLBL3MBTL1
SCHEMBL13436776 0.83 MAPT (0.60) MAPTKMT2AMEN1POLBL3MBTL1
SCHEMBL15679893 0.82 MAPT (0.58) MAPTKMT2AMEN1POLBL3MBTL1
SCHEMBL30811587 0.81 MAPT (0.72) MAPTKMT2AMEN1POLBL3MBTL1
SCHEMBL21628256 0.81 MAPT (0.72) MAPTKMT2AMEN1POLBL3MBTL1
SCHEMBL29636451 0.81 MAPT (0.72) MAPTKMT2AMEN1POLBL3MBTL1
Phenoxazine SCHEMBL27280590 0.79 MAPT (0.65) MAPTKMT2AMEN1POLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260102407-A1 TREATMENT METHODS KHACHIGIAN LEVON MICHAEL (AU) 2026-04-16 US disclosed
US-20240050444-A1 TREATMENT METHODS VASCULAR THERAPEUTICS PTY LTD (AU) 2024-02-15 US disclosed
EP-4117655-A1 TREATMENT METHODS Khachigian, Levon, Michael (AU) 2023-01-18 EP disclosed
WO-2021184059-A1 TREATMENT METHODS NEWSOUTH INNOVATIONS PTY LIMITED (AU) 2021-09-23 WO disclosed
US-20080275023-A1 N-Hydroxyamides Omege-Substituted with Tricyclic Groups as Histone Deacetylase Inhibitors, Their Preparation and Use in Pharmaceutical Formulations MENARIN INTERNATIONAL OPERATIONS LUXEMBOURG S.A. (LU) 2008-11-06 US disclosed
US-7410975-B2 Small molecule toll-like receptor (TLR) antagonists COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-08-12 US disclosed
EP-1863776-A1 N-HYDROXYAMIDES OMEGA-SUBSTITUTED WITH TRICYCLIC GROUPS AS HISTONE DEACETYLASE INHIBITORS, THEIR PREPARATION AND USE IN PHARMACEUTICAL FORMULATIONS Menarini International Operations Luxembourg S.A. (LU) 2007-12-12 EP disclosed
US-20070232622-A1 Small molecule toll-like receptor (TLR) antagonists COLEY PHARMACEUTICAL GMBH (DE) 2007-10-04 US disclosed
WO-2006097449-A1 N-HYDROXYAMIDES OMEGA-SUBSTITUTED WITH TRICYCLIC GROUPS AS HISTONE DEACETYLASE INHIBITORS, THEIR PREPARATION AND USE IN PHARMACEUTICAL FORMULATIONS MENARINI INTERNATIONAL OPERATIONS LUXEMBOURG S.A. (LU) 2006-09-21 WO disclosed
US-6919328-B1 Tricyclic compounds with NOS activity NEURAXON INC. (CA) 2005-07-19 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 (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-20240050444-A1 TREATMENT METHODS FOSB, FOS, VCAM1 MAPT 2602/4885KMT2A 4344/4885MEN1 4247/4885
US-20070232622-A1 Small molecule toll-like receptor (TLR) antagonists TLR3, TLR8, TLR7 MAPT 3823/4885KMT2A 899/4885MEN1 3966/4885
US-20260102407-A1 TREATMENT METHODS FOSB, VCAM1, FOS MAPT 3149/4885KMT2A 4507/4885MEN1 2796/4885
US-20080275023-A1 N-Hydroxyamides Omege-Substituted with Tricyclic Groups as Histone Deacetylase Inhibitors, Their Preparation and Use in Pharmaceutical Formulations HDAC8, HDAC2, HDAC7 MAPT 2847/4885KMT2A 45/4885MEN1 3533/4885

“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.