SCHEMBL10263261

SCHEMBL10263261

CC(=O)c1cc2c([nH]1)CCCC2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.59
ALDH1A1 P00352 7/20 0.56
HPGD P15428 4/20 0.56
HSD17B10 Q99714 4/20 0.56
KDM4E B2RXH2 3/20 0.56
MAPT P10636 4/20 0.43
ALOX15 P16050 3/20 0.43
LMNA P02545 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
ALOX12 P18054 2/20 0.43
TSHR P16473 2/20 0.43
TP53 P04637 1/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
HTT P42858 1/20 0.40
APOBEC3G Q9HC16 1/20 0.39
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
PDGFRB P09619 3/20 0.36

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
SCHEMBL1423043 0.84 ALDH1A1 (0.65) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL8168410 0.82 ALDH1A1 (0.62) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL8163967 0.82 ALDH1A1 (0.62) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL14933884 0.81 ALDH1A1 (0.56) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL24104986 0.81 HRH4 (0.51) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL20345515 0.80 HRH4 (0.55) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL7047669 0.80 HRH4 (0.55) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL1004852 0.80 ALDH1A1 (0.59) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL15101736 0.79 HRH4 (0.54) HRH4ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL21975324 0.79 HRH4 (0.54) HRH4ALDH1A1HPGDHSD17B10KDM4E

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
US-20230279012-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2023-09-07 US disclosed
US-20230014173-A1 Antibacterial Compounds JANSSEN SCIENCES IRELAND UC (IE) 2023-01-19 US disclosed
US-20210079002-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2021-03-18 US disclosed
US-20200062769-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2020-02-27 US disclosed
US-20190330189-A1 ANTIBACTERIAL COMPOUNDS JANSSEN SCIENCES IRELAND UC (IE) 2019-10-31 US disclosed
US-10364232-B2 Antibacterial compounds JANSSEN SCIENCES IRELAND UC (IE) 2019-07-30 US disclosed
US-20180186768-A1 Antibacterial Compounds JANSSEN SCIENCES IRELAND UC (IE) 2018-07-05 US disclosed
US-20180179229-A1 PYRIDONE AND AZA-PYRIDONE COMPOUNDS AND METHODS OF USE GILEAD CONNECTICUT, INC. (US) 2018-06-28 US disclosed
US-20180071286-A1 HETEROARYL PYRIDONE AND AZA-PYRODINE COMPOUNDS GENENTECH, INC. (US) 2018-03-15 US disclosed
US-20180071286-A1 HETEROARYL PYRIDONE AND AZA-PYRODINE COMPOUNDS GENENTECH, INC. (US) 2018-03-15 US disclosed
US-20140221365-A1 ALKYLATED PIPERAZINE COMPOUNDS GENENTECH, INC. (US) 2014-08-07 US disclosed
US-20140194408-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2014-07-10 US disclosed
US-8729072-B2 Alkylated piperazine compounds F. HOFFMAN-LA ROCHE AG (CH) 2014-05-20 US disclosed
US-8722676-B2 Bicyclic piperazine compounds GENENTECH, INC. (US) 2014-05-13 US disclosed
US-8716274-B2 Heteroaryl pyridone and aza-pyridone compounds GENENTECH, INC. (US) 2014-05-06 US disclosed
US-20140057896-A1 PYRIDONE AND AZA-PYRIDONE COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2014-02-27 US disclosed
US-20130116262-A1 BICYCLIC PIPERAZINE COMPOUNDS GENENTECH, INC. (US) 2013-05-09 US disclosed
US-20130116245-A1 ALKYLATED PIPERAZINE COMPOUNDS GENENTECH, INC. (US) 2013-05-09 US disclosed
US-20130116235-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2013-05-09 US disclosed
US-20120010191-A1 PYRIDONE AND AZA-PYRIDONE COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2012-01-12 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 (16 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-20140221365-A1 ALKYLATED PIPERAZINE COMPOUNDS BTK, SYK, LCK HRH4 2256/4885ALDH1A1 3275/4885HPGD 3089/4885
US-20180071286-A1 HETEROARYL PYRIDONE AND AZA-PYRODINE COMPOUNDS TYK2, BTK, PDXK HRH4 714/4885ALDH1A1 4684/4885HPGD 1093/4885
US-20190330189-A1 ANTIBACTERIAL COMPOUNDS FDPS, SQOR, NDUFS3 HRH4 2052/4885ALDH1A1 1869/4885HPGD 976/4885
US-10364232-B2 Antibacterial compounds FDPS, SQOR, NDUFS3 HRH4 2052/4885ALDH1A1 1869/4885HPGD 976/4885
US-20140057896-A1 PYRIDONE AND AZA-PYRIDONE COMPOUNDS AND METHODS OF USE PDXK, BTK, LCK HRH4 680/4885ALDH1A1 3206/4885HPGD 735/4885
US-20120010191-A1 PYRIDONE AND AZA-PYRIDONE COMPOUNDS AND METHODS OF USE PDXK, BTK, LCK HRH4 680/4885ALDH1A1 3206/4885HPGD 735/4885
US-20130116245-A1 ALKYLATED PIPERAZINE COMPOUNDS BTK, SYK, LCK HRH4 1222/4885ALDH1A1 3511/4885HPGD 2456/4885
US-20180186768-A1 Antibacterial Compounds FDPS, SQOR, NDUFS3 HRH4 2052/4885ALDH1A1 1869/4885HPGD 976/4885
US-20230014173-A1 Antibacterial Compounds FDPS, SQOR, NDUFS3 HRH4 2052/4885ALDH1A1 1869/4885HPGD 976/4885
US-20200062769-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS PDXK, BTK, TYK2 HRH4 516/4885ALDH1A1 4561/4885HPGD 1222/4885
US-20180179229-A1 PYRIDONE AND AZA-PYRIDONE COMPOUNDS AND METHODS OF USE PDXK, BTK, LCK HRH4 680/4885ALDH1A1 3206/4885HPGD 735/4885
US-20230279012-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS PDXK, BTK, TYK2 HRH4 516/4885ALDH1A1 4561/4885HPGD 1222/4885
US-20130116235-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS BTK, PDXK, TYK2 HRH4 552/4885ALDH1A1 4251/4885HPGD 1266/4885
US-20140194408-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS BTK, PDXK, TYK2 HRH4 552/4885ALDH1A1 4251/4885HPGD 1266/4885
US-20130116262-A1 BICYCLIC PIPERAZINE COMPOUNDS BTK, LCK, SYK HRH4 1040/4885ALDH1A1 3810/4885HPGD 2070/4885
US-20210079002-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS PDXK, BTK, TYK2 HRH4 516/4885ALDH1A1 4561/4885HPGD 1222/4885

“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.