SCHEMBL3669707

SCHEMBL3669707

Cc1cn(C)cc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.48
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HAAO P46952 1/20 0.36
GAA P10253 1/20 0.36
MYC P01106 3/20 0.35
NR4A1 P22736 2/20 0.35
HMGB1 P09429 1/20 0.35
CXCL12 P48061 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35

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
SCHEMBL69773 0.85 NOTUM (0.44) NOTUMKDM4EALDH1A1HPGDHSD17B10
SCHEMBL13790595 0.81 SMN1; SMN2 (0.38) NOTUMKDM4EALDH1A1GAACYP1A2
SCHEMBL4030620 0.79 NOTUM (0.32) NOTUM
SCHEMBL5176186 0.78 ALDH1A1 (0.41) NOTUMKDM4EALDH1A1HPGDHSD17B10
SCHEMBL4029538 0.76
SCHEMBL13757990 0.76 BRD4 (0.42) KDM4EGAA
SCHEMBL21428265 0.76 NR4A2 (0.43) KDM4EALDH1A1HSD17B10GAAMYC
SCHEMBL7097879 0.74 NOTUM (0.41) NOTUMKDM4EALDH1A1HPGDHSD17B10
SCHEMBL5175113 0.74 KDM4E (0.41) NOTUMKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9611418 0.74 NOTUM (0.50) NOTUMKDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1252140-B1 PYRROLECARBOXAMIDES AND PYRROLETHIOAMIDES AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-05-13 EP claimed
US-20230062975-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS SPRING MILL PHARMA, INC. 2023-03-02 US disclosed
US-20230062975-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS SPRING MILL PHARMA, INC. 2023-03-02 US disclosed
US-11566001-B2 Hepatitis B capsid assembly modulators VenatoRx Pharmaceuticals, Inc. (US) 2023-01-31 US disclosed
US-11566001-B2 Hepatitis B capsid assembly modulators VenatoRx Pharmaceuticals, Inc. (US) 2023-01-31 US disclosed
US-20220298110-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS SPRING MILL PHARMA, INC. 2022-09-22 US disclosed
US-11247965-B2 Hepatitis B capsid assembly modulators VenatoRx Pharmaceuticals, Inc. (US) 2022-02-15 US disclosed
CN-113056461-A Arylsulfonyl pyrrole carboxamide derivatives as Kv3 potassium channel activators H.隆德贝克有限公司 2021-06-29 CN disclosed
US-20210171439-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS VenatoRx Pharmaceuticals, Inc. (US) 2021-06-10 US disclosed
US-11014881-B2 Hepatitis B capsid assembly modulators VenatoRx Pharmaceuticals, Inc. (US) 2021-05-25 US disclosed
US-20090163488-A1 FUSED HETEROCYCLE DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-25 US disclosed
EP-1252140-B1 PYRROLECARBOXAMIDES AND PYRROLETHIOAMIDES AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-05-13 EP disclosed
WO-2008150015-A1 HETEROBICYCLIC COMPOUNDS AS KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-11 WO disclosed
US-7087638-B2 Pyrrolecarboxamides and pyrrolethioamides as fungicides SYNGENTA CROP PROTECTION, INC. (US) 2006-08-08 US disclosed
CN-1255380-C Pyrroleamide and pyrrolethioamide fungicides SYNGENTA PARTICIPATIONS AG (CH) 2006-05-10 CN disclosed
US-6806286-B2 CONTROLLING PHYTOPATHOGENIC MICROORGANISMS FROM INFESTING PLANTS SYNGENTA CROP PROTECTION, INC. 2004-10-19 US disclosed
US-20040106521-A1 Plant safening agents; SYNGENTA CROP PROTECTION, INC. 2004-06-03 US disclosed
US-20040049035-A1 Pyrrolecarboxamides and pyrrolethioamides as fungicides SYNGENTA CROP PROTECTION, INC. 2004-03-11 US disclosed
CN-1427823-A Pyrrolecarboxamides and pyrrolethioamides as fungicides SYNGENTA PARTICIPATIONS AG (CH) 2003-07-02 CN disclosed
US-4548696-A 3,4-Disubstituted polypyrroles and articles of manufacture coated therewith OLIN CORPORATION (US) 1985-10-22 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 (9 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-20230062975-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS HAVCR2, COPB1, HDLBP NOTUM 4325/4885KDM4E 3751/4885ALDH1A1 3850/4885
US-11566001-B2 Hepatitis B capsid assembly modulators HAVCR2, COPB1, HDLBP NOTUM 4325/4885KDM4E 3751/4885ALDH1A1 3850/4885
US-20220298110-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS HAVCR2, COPB1, HDLBP NOTUM 4325/4885KDM4E 3751/4885ALDH1A1 3850/4885
US-20210171439-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS HAVCR2, COPB1, HDLBP NOTUM 4325/4885KDM4E 3751/4885ALDH1A1 3850/4885
US-11247965-B2 Hepatitis B capsid assembly modulators HAVCR2, COPB1, HDLBP NOTUM 4325/4885KDM4E 3751/4885ALDH1A1 3850/4885
US-20040106521-A1 Plant safening agents; CBR3, CBR1, CYCS NOTUM 1808/4885KDM4E 3053/4885ALDH1A1 2553/4885
US-11014881-B2 Hepatitis B capsid assembly modulators HAVCR2, COPB1, HDLBP NOTUM 4325/4885KDM4E 3751/4885ALDH1A1 3850/4885
US-20090163488-A1 FUSED HETEROCYCLE DERIVATIVES AND USE THEREOF NOX3, NOX5, ZYX NOTUM 2881/4885KDM4E 2148/4885ALDH1A1 2812/4885
US-20040049035-A1 Pyrrolecarboxamides and pyrrolethioamides as fungicides CBR3, CBR1, PPOX NOTUM 482/4885KDM4E 877/4885ALDH1A1 3025/4885

“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.