SCHEMBL10173054

SCHEMBL10173054

Brc1ccc(-c2nc3cc(Br)ccc3o2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.64
SMN1; SMN2 Q16637 7/20 0.59
NPC1 O15118 6/20 0.59
RAB9A P51151 6/20 0.59
KDM4E B2RXH2 6/20 0.59
TP53 P04637 5/20 0.59
HSD17B10 Q99714 4/20 0.59
ALDH1A1 P00352 4/20 0.59
HPGD P15428 3/20 0.59
RXFP1 Q9HBX9 2/20 0.59
ESR1 P03372 2/20 0.59
ESR2 Q92731 2/20 0.59
GFER P55789 1/20 0.59
PTPN2 P17706 2/20 0.58
PTPN1 P18031 2/20 0.58
PTPN5 P54829 2/20 0.58
MAPT P10636 5/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
NFKB1 P19838 2/20 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
SCHEMBL2247467 0.90 RAB9A (0.76) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL25752031 0.90 HDAC6 (0.55) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL25498923 0.90 SMN1; SMN2 (0.62) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL2242768 0.90 SMN1; SMN2 (0.63) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL2245900 0.90 NPC1 (0.76) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL25625041 0.90 HDAC6 (0.55) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL9966868 0.89 SMN1; SMN2 (0.66) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL29407356 0.89 SMN1; SMN2 (0.66) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL17283310 0.89 HDAC6 (0.59) HDAC6SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL9857519 0.89 HDAC6 (0.57) HDAC6SMN1; SMN2NPC1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112119675-B Organic electroluminescent element 保土谷化学工业株式会社 2024-08-09 CN disclosed
US-20220356182-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2022-11-10 US disclosed
US-20210226132-A1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO., LTD. (JP) 2021-07-22 US disclosed
US-11053243-B2 Inhibitors of hepatitis C virus replication MERCK SHARP & DOHME CORP. (US) 2021-07-06 US disclosed
EP-3826430-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2021-05-26 EP disclosed
CN-112119675-A Organic electroluminescent element 保土谷化学工业株式会社 2020-12-22 CN disclosed
US-20200262836-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2020-08-20 US disclosed
US-20190127365-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2019-05-02 US disclosed
US-20170008906-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2017-01-12 US disclosed
US-20170008906-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2017-01-12 US disclosed
US-20150246917-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2015-09-03 US disclosed
US-9090661-B2 Inhibitors of hepatitis C virus replication MERCK SHARP & DOHME CORP. (US) 2015-07-28 US disclosed
US-9090661-B2 Inhibitors of hepatitis C virus replication MERCK SHARP & DOHME CORP. (US) 2015-07-28 US disclosed
US-20140371138-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2014-12-18 US disclosed
US-20140371138-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2014-12-18 US disclosed
US-8871759-B2 Inhibitors of hepatitis C virus replication MERCK SHARP & DOHME CORP. (US) 2014-10-28 US disclosed
US-8871759-B2 Inhibitors of hepatitis C virus replication MERCK SHARP & DOHME CORP. (US) 2014-10-28 US disclosed
US-20120083483-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP (NJ) 2012-04-05 US disclosed
US-20120083483-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP (NJ) 2012-04-05 US disclosed
WO-2010111483-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION MERCK SHARP & DOHME CORP. (US) 2010-09-30 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 (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-20200262836-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION HAVCR2, HCCS, EIF2AK2 HDAC6 724/4885SMN1; SMN2 4833/4885NPC1 141/4885
US-20120083483-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION HAVCR2, HCCS, EIF2AK2 HDAC6 724/4885SMN1; SMN2 4833/4885NPC1 141/4885
US-20210226132-A1 ORGANIC ELECTROLUMINESCENT ELEMENT SLC39A14, SLC39A7, SLC39A3 HDAC6 1344/4885SMN1; SMN2 2461/4885NPC1 1687/4885
US-20140371138-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION HAVCR2, HCCS, EIF2AK2 HDAC6 724/4885SMN1; SMN2 4833/4885NPC1 141/4885
US-20170008906-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION HAVCR2, HCCS, EIF2AK2 HDAC6 724/4885SMN1; SMN2 4833/4885NPC1 141/4885
US-20150246917-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION HAVCR2, HCCS, EIF2AK2 HDAC6 724/4885SMN1; SMN2 4833/4885NPC1 141/4885
US-11053243-B2 Inhibitors of hepatitis C virus replication HAVCR2, HCCS, EIF2AK2 HDAC6 724/4885SMN1; SMN2 4833/4885NPC1 141/4885
US-20190127365-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION HAVCR2, HCCS, EIF2AK2 HDAC6 724/4885SMN1; SMN2 4833/4885NPC1 141/4885
US-20220356182-A1 INHIBITORS OF HEPATITIS C VIRUS REPLICATION HAVCR2, HCCS, EIF2AK2 HDAC6 724/4885SMN1; SMN2 4833/4885NPC1 141/4885

“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.