SCHEMBL4729573

SCHEMBL4729573

c1ccc2sc(-c3ccncc3)nc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 1.00
NPC1 O15118 7/20 1.00
KDM4E B2RXH2 6/20 1.00
APP P05067 5/20 0.66
MAPT P10636 3/20 0.66
ALDH1A1 P00352 3/20 0.66
GLA P06280 2/20 0.66
GAA P10253 2/20 0.66
MMP9 P14780 2/20 0.66
MMP8 P22894 2/20 0.66
LMNA P02545 1/20 0.66
SMN1; SMN2 Q16637 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
PKM P14618 1/20 0.60
PAX8 Q06710 1/20 0.60
NOD2 Q9HC29 1/20 0.60
TNF P01375 1/20 0.60
NOD1 Q9Y239 1/20 0.60

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
SCHEMBL8994279 0.90 RAB9A (0.84) RAB9ANPC1KDM4EAPPMAPT
SCHEMBL366824 0.88 RAB9A (0.81) RAB9ANPC1KDM4EAPPMAPT
SCHEMBL29474819 0.88 RAB9A (0.81) RAB9ANPC1KDM4EAPPMAPT
SCHEMBL25547107 0.87 NPC1 (0.77) RAB9ANPC1KDM4EAPPMAPT
SCHEMBL25543975 0.87 RAB9A (0.77) RAB9ANPC1KDM4EAPPMAPT
SCHEMBL24295138 0.86 RAB9A (0.79) RAB9ANPC1KDM4EAPPMAPT
2-Phenylbenzo[D]Thiazole SCHEMBL30988131 0.86 RAB9A (0.75) RAB9ANPC1KDM4EAPPMAPT
2-Phenylbenzo[D]Thiazole SCHEMBL94005 0.86 RAB9A (0.75) RAB9ANPC1KDM4EAPPMAPT
SCHEMBL4593799 0.85 NPC1 (0.73) RAB9ANPC1KDM4EAPPMAPT
2-Phenylbenzo[D]Thiazole SCHEMBL2453217 0.84 RAB9A (0.72) RAB9ANPC1KDM4EAPPMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4019607-B1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INT (FR) 2024-05-15 EP disclosed
US-20240052235-A1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2024-02-15 US disclosed
CN-116783168-A Electrochromic compounds and optical articles comprising the same 依视路国际公司 2023-09-19 CN disclosed
US-20220332712-A1 HETEROARYL-PYRIDINIUM COMPOUND AND REDOX FLOW BATTERY COMPRISING THE SAME PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2022-10-20 US disclosed
WO-2022136020-A1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2022-06-30 WO disclosed
WO-2022136020-A1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2022-06-30 WO disclosed
EP-4019607-A1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2022-06-29 EP disclosed
EP-4019607-A1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2022-06-29 EP disclosed
WO-2021110890-A1 PYRIDINIUM DERIVATIVES AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2021-06-10 WO disclosed
CN-103588794-B A kind of univalent copper complex luminescent material and its preparation method CHINA JILIANG UNIVERSITY (CN) 2016-06-01 CN disclosed
CN-103992291-B Method for synthesizing 2-substituted benzothiazole derivative NANJING TECH UNIVERSITY (CN) 2016-02-10 CN disclosed
CN-103450111-B Green synthesis method of benzothiazole heterocyclic compound UNIV WENZHOU 2015-07-08 CN disclosed
CN-103992291-A Method for synthesizing 2-substituted benzothiazole derivative NANJING UNIVERSITY OF TECHNOLOGY 2014-08-20 CN disclosed
CN-103450111-A Green synthesis method of benzothiazole heterocyclic compound UNIV WENZHOU 2013-12-18 CN disclosed
US-20120263646-A1 IMAGING AGENTS AND THEIR USE FOR THE DIAGNOSTIC IN VIVO OF NEURODEGENERATIVE DISEASES, NOTABLY ALZHEIMER'S DISEASE AND DERIVATIVE DISEASES GUERBET (FR) 2012-10-18 US disclosed
WO-2008021210-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS COMBINATORX, INCORPORATED (US) 2008-02-21 WO disclosed
US-20080044390-A1 Methods and compositions for the treatment of neurodegenerative disorders CHDI, INCORPORATED 2008-02-21 US disclosed
US-5874431-A ANTITUMOR AGENTS; BREAST CANCER CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1999-02-23 US disclosed
US-5849765-A Tetrahydropyridine derivatives as dopamine receptor subtype ligands MERCK SHARP & DOHME, LTD. (GB) 1998-12-15 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 (4 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-20240052235-A1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM EYA3, LAGE3, CDKL5 RAB9A 2687/4885NPC1 4449/4885KDM4E 1272/4885
US-20120263646-A1 IMAGING AGENTS AND THEIR USE FOR THE DIAGNOSTIC IN VIVO OF NEURODEGENERATIVE DISEASES, NOTABLY ALZHEIMER'S DISEASE AND DERIVATIVE DISEASES SNCA, PSEN2, CLN6 RAB9A 496/4885NPC1 30/4885KDM4E 4711/4885
US-20080044390-A1 Methods and compositions for the treatment of neurodegenerative disorders HTT, SNCA, NLN RAB9A 2207/4885NPC1 78/4885KDM4E 3242/4885
US-20220332712-A1 HETEROARYL-PYRIDINIUM COMPOUND AND REDOX FLOW BATTERY COMPRISING THE SAME NOX4, DUOX1, PNPO RAB9A 1298/4885NPC1 4380/4885KDM4E 2720/4885

“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.