SCHEMBL4766358

SCHEMBL4766358

N#Cc1ccccc1NC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.69
KDM4E B2RXH2 5/20 0.69
L3MBTL1 Q9Y468 2/20 0.60
ALDH1A1 P00352 4/20 0.59
TSHR P16473 1/20 0.57
GLA P06280 1/20 0.57
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
CYP1A2 P05177 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PDK1 Q15118 1/20 0.55
PDK2 Q15119 1/20 0.55
PDK3 Q15120 1/20 0.55
PDK4 Q16654 1/20 0.55
HPGD P15428 1/20 0.55
NLRP3 Q96P20 1/20 0.55
CXCR2 P25025 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53

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
SCHEMBL6858019 0.86 GAA (0.66) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL11786623 0.85 GAA (0.65) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL30107521 0.84 GAA (0.64) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL6222692 0.84 GAA (0.64) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL11789215 0.83 GAA (0.63) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL1343798 0.83 KDM4E (0.63) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL29769835 0.82 L3MBTL1 (0.63) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL1084996 0.82 L3MBTL1 (0.63) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL20456029 0.82 GAA (0.65) GAAKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL13210703 0.81 RAB9A (0.65) GAAKDM4EL3MBTL1ALDH1A1TSHR

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
WO-2024124279-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF CERTA THERAPEUTICS PTY LTD (AU) 2024-06-20 WO disclosed
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
EP-4013508-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES Bayer Aktiengesellschaft (DE) 2022-06-22 EP disclosed
WO-2021077102-A1 NOVEL ANTIPARASITIC COMPOUNDS AND METHODS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-04-22 WO disclosed
WO-2021028382-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2021-02-18 WO disclosed
WO-2015088564-A1 P2X4 RECEPTOR MODULATING COMPOUNDS SUNOVION PHARMACEUTICALS INC. (US) 2015-06-18 WO disclosed
WO-2015088565-A1 P2X4 RECEPTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2015-06-18 WO disclosed
EP-1722796-A4 TETRACYCLIC LACTAM DERIVATIVES AND USES THEREOF INOTEK PHARMACEUTICALS CORP (US) 2008-01-23 EP disclosed
WO-2007117289-A2 METHODS FOR TREATING OR PREVENTING ERECTILE DYSFUNCTION OR URINARY INCONTINENCE INOTEK PHARMACEUTICALS CORPORATION (US) 2007-10-18 WO disclosed
CN-101014343-A Tetracyclic lactam derivatives and uses thereof INOTEK PHARMACEUTICALS CORP (US) 2007-08-08 CN disclosed
EP-1722796-A2 TETRACYCLIC LACTAM DERIVATIVES AND USES THEREOF Inotek Pharmaceuticals Corporation (US) 2006-11-22 EP disclosed
WO-2005082079-A2 TETRACYCLIC LACTAM DERIVATIVES AND USES THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2005-09-09 WO disclosed
US-4578389-A HYPOTENSIVE AGENTS LUDWIG HEUMANN & CO. GMBH (DE) 1986-03-25 US disclosed
US-4578389-A HYPOTENSIVE AGENTS LUDWIG HEUMANN & CO. GMBH (DE) 1986-03-25 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 (1 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-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES AHR, HRH4, HRH1 GAA 3740/4885KDM4E 1364/4885L3MBTL1 2991/4885

“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.