SCHEMBL4517570

SCHEMBL4517570

O=[N+]([O-])c1ccccc1-c1cc[c]o1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
TDP1 Q9NUW8 2/20 0.50
LMNA P02545 1/20 0.47
L3MBTL1 Q9Y468 4/20 0.43
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
MAPT P10636 4/20 0.43
MAPK1 P28482 3/20 0.43
KDM4E B2RXH2 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
GAA P10253 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
APAF1 O14727 1/20 0.43
SLC9A1 P19634 1/20 0.43
BRAF P15056 1/20 0.42
PKM P14618 2/20 0.42
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42

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
SCHEMBL3400235 0.76 ALDH1A1 (0.59) ALDH1A1TDP1LMNAL3MBTL1KMT2A
SCHEMBL30535903 0.74 ALDH1A1 (0.74) ALDH1A1TDP1L3MBTL1KMT2AMEN1
SCHEMBL1287837 0.74 ALDH1A1 (0.74) ALDH1A1TDP1L3MBTL1KMT2AMEN1
SCHEMBL4601208 0.74 MAPT (0.57) ALDH1A1TDP1LMNAL3MBTL1KMT2A
SCHEMBL30987815 0.72 ALDH1A1 (0.71) ALDH1A1TDP1L3MBTL1KMT2AMEN1
SCHEMBL29337140 0.72 ALDH1A1 (0.71) ALDH1A1TDP1L3MBTL1KMT2AMEN1
Ammonia Solution, Strong SCHEMBL9060371 0.72 ALDH1A1 (0.71) ALDH1A1TDP1L3MBTL1KMT2AMEN1
SCHEMBL5557695 0.71 ALDH1A1 (0.53) ALDH1A1TDP1LMNAL3MBTL1KMT2A
SCHEMBL4375599 0.71 ALDH1A1 (0.53) ALDH1A1TDP1LMNAL3MBTL1KMT2A
SCHEMBL10337930 0.71 ALDH1A1 (0.57) ALDH1A1TDP1L3MBTL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11905279-B1 Benzylidene derivatives of fenobam as anti-inflammatory agents King Faisal University (SA) 2024-02-20 US claimed
CN-101775020-A Poly-substituted chromone pyrrole compound and synthetic method and application thereof UNIV SUN YAT SEN 2010-07-14 CN claimed
US-20090306122-A1 SUBSTITUTED TETRAHYDROPYRROLOQUINOLINE DERIVATIVES AS KINASE MODULATORS, ESPECIALLY OF TYROSINE AND RAF KINASES MERCK PATENT GMBH (DE) 2009-12-10 US claimed
EP-1856116-A1 SUBSTITUTED TETRAHYDROPYRROLOQUINOLINE DERIVATIVES AS KINASE MODULATORS, ESPECIALLY TYROSINE KINASE AND RAF KINASE MODULATORS Merck Patent GmbH (DE) 2007-11-21 EP claimed
WO-2006094600-A1 SUBSTITUTED TETRAHYDROPYRROLOQUINOLINE DERIVATIVES AS KINASE MODULATORS, ESPECIALLY TYROSINE KINASE AND RAF KINASE MODULATORS MERCK PATENT GMBH (DE) 2006-09-14 WO claimed
US-20040023972-A1 Use of substituted imidazo[1,2-a]-pyridin-, -pyrimidin-and-pyrazin-3-yl-amine derivatives in the preparation of medicaments for inhibiting NOS GRUENENTHAL GMBH (DE) 2004-02-05 US claimed
EP-1257265-B1 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS BIOAGENCY AG (DE) 2004-01-21 EP claimed
EP-1326613-A1 USE OF SUBSTITUTED IMIDAZO 1,2-A]PYRIDINE-, IMIDAZO 1,2-A]PYRIMIDINE AND IMIDAZO 1,2-A]PYRAZINE-3-YL-AMINE DERIVATIVES FOR PRODUCING NOS-INHIBITING MEDICAMENTS Grünenthal GmbH (DE) 2003-07-16 EP claimed
US-20030036532-A1 Use of 2-phenylene diamine derivatives for the treatment of infections JOMAA PHARMAKA GMBH (DE) 2003-02-20 US claimed
EP-1257265-A2 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS Jomaa Pharmaka GmbH (DE) 2002-11-20 EP claimed
US-20020086895-A1 Methods of treating fungal infections CHU WAI-LAM ALEX (US) 2002-07-04 US claimed
WO-2002030428-A1 USE OF SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE-, IMIDAZO[1,2-A]PYRIMIDINE AND IMIDAZO[1,2-A]PYRAZINE-3-YL-AMINE DERIVATIVES FOR PRODUCING NOS-INHIBITING MEDICAMENTS Grünenthal GmbH (DE) 2002-04-18 WO claimed
EP-1005338-A4 SUBSTITUTED AURONE DERIVATIVES PHYTERA INC (US) 2001-11-07 EP claimed
WO-2001070026-A2 2-PHENYLENEDIAMINE DERIVATIVES AS HERBICIDES JOMAA PHARMAKA GMBH (DE) 2001-09-27 WO claimed
WO-2001062709-A2 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS JOMAA PHARMAKA GMBH (DE) 2001-08-30 WO claimed
EP-1005338-A1 SUBSTITUTED AURONE DERIVATIVES PHYTERA, INC. (US) 2000-06-07 EP claimed
WO-1999004789-A1 SUBSTITUTED AURONE DERIVATIVES PHYTERA, INC. (US) 1999-02-04 WO claimed
US-11905279-B1 Benzylidene derivatives of fenobam as anti-inflammatory agents King Faisal University (SA) 2024-02-20 US disclosed
EP-1005338-A1 SUBSTITUTED AURONE DERIVATIVES PHYTERA, INC. (US) 2000-06-07 EP disclosed
WO-1999004789-A1 SUBSTITUTED AURONE DERIVATIVES PHYTERA, INC. (US) 1999-02-04 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 (5 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-20030036532-A1 Use of 2-phenylene diamine derivatives for the treatment of infections HRH2, ASPH, NQO2 ALDH1A1 1419/4885TDP1 4770/4885LMNA 3574/4885
US-20020086895-A1 Methods of treating fungal infections COXFA4L2, DPM1, ERG28 ALDH1A1 1149/4885TDP1 2888/4885LMNA 4046/4885
US-11905279-B1 Benzylidene derivatives of fenobam as anti-inflammatory agents PTGS1, PTGES2, PTGS2 ALDH1A1 658/4885TDP1 3486/4885LMNA 3877/4885
US-20090306122-A1 SUBSTITUTED TETRAHYDROPYRROLOQUINOLINE DERIVATIVES AS KINASE MODULATORS, ESPECIALLY OF TYROSINE AND RAF KINASES TIE1, FER, RET ALDH1A1 3078/4885TDP1 1596/4885LMNA 3089/4885
US-20040023972-A1 Use of substituted imidazo[1,2-a]-pyridin-, -pyrimidin-and-pyrazin-3-yl-amine derivatives in the preparation of medicaments for inhibiting NOS NOS1, PTGIS, NOS2 ALDH1A1 3066/4885TDP1 236/4885LMNA 802/4885

“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.