SCHEMBL4131855

SCHEMBL4131855

O=Cc1ccc(OCCn2ccnc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 13/20 0.70
KDM4E B2RXH2 1/20 0.68
ALDH1A1 P00352 1/20 0.68
MAPK1 P28482 1/20 0.68
LTA4H P09960 1/20 0.66
KMT2A Q03164 2/20 0.64
MEN1 O00255 1/20 0.64
LMNA P02545 1/20 0.64
NOS1 P29475 1/20 0.63

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
SCHEMBL8995364 0.93 QPCT (0.69) TBXAS1KDM4EKMT2AMEN1LMNA
SCHEMBL25344191 0.85 TBXAS1 (0.64) TBXAS1KDM4EALDH1A1LTA4HKMT2A
SCHEMBL29569737 0.85 TBXAS1 (0.64) TBXAS1KDM4EALDH1A1LTA4HKMT2A
SCHEMBL8995204 0.84 TBXAS1 (0.51) TBXAS1KDM4EALDH1A1MAPK1LTA4H
SCHEMBL10856315 0.83 TBXAS1 (1.00) TBXAS1KMT2AMEN1LMNA
SCHEMBL10856322 0.83 TBXAS1 (1.00) TBXAS1KMT2AMEN1LMNA
SCHEMBL8995313 0.82 TBXAS1 (0.74) TBXAS1KDM4EALDH1A1MAPK1LTA4H
SCHEMBL8690248 0.81 KMT2A (0.83) TBXAS1KDM4EALDH1A1MAPK1LTA4H
SCHEMBL8684965 0.81 MAPK1 (1.00) TBXAS1KDM4EALDH1A1MAPK1LTA4H
SCHEMBL76839 0.81 KDM4E (0.72) TBXAS1KDM4EALDH1A1MAPK1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116940562-A Acetamido-phenylbenzamide derivatives and methods of use thereof 希华医药有限公司 2023-10-24 CN disclosed
EP-4225745-A1 ACETAMIDO-PHENYLBENZAMIDE DERIVATIVES AND METHODS OF USING THE SAME Athenex, Inc. (US) 2023-08-16 EP disclosed
WO-2022076662-A1 ACETAMIDO-PHENYLBENZAMIDE DERIVATIVES AND METHODS OF USING THE SAME ATHENEX, INC. (US) 2022-04-14 WO disclosed
US-20220106301-A1 ACETAMIDO-PHENYLBENZAMIDE DERIVATIVES AND METHODS OF USING THE SAME Health Hope Pharma Limited (HK) 2022-04-07 US disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
EP-1940823-A2 SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 EP disclosed
WO-2007042660-A2 SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-04-19 WO disclosed
EP-0557787-B1 Imidazolylphenol derivatives, medicaments containing them and a process for the preparation of these compounds and medicaments GRUENENTHAL GMBH (DE) 2000-05-24 EP disclosed
US-5496844-A Indole derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1996-03-05 US disclosed
EP-0639567-A1 INDOLE DERIVATIVE OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1995-02-22 EP disclosed
US-5356921-A Exhibit 5-lipoxygenase and thromboxane synthase inhibiting activities; administering for disorders attributable to the action of leukotrienes and thromboxane A2 GRUENENTHAL GMBH (DE) 1994-10-18 US disclosed
EP-0557787-A1 Imidazolylphenol derivatives, medicaments containing them and a process for the preparation of these compounds and medicaments Grünenthal GmbH (DE) 1993-09-01 EP 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-20220106301-A1 ACETAMIDO-PHENYLBENZAMIDE DERIVATIVES AND METHODS OF USING THE SAME ABCB1, ABCC1, UGT2B7 TBXAS1 1100/4885KDM4E 2232/4885ALDH1A1 102/4885
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AGTR1, AGTR2, AHR TBXAS1 2072/4885KDM4E 1737/4885ALDH1A1 60/4885

“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.