SCHEMBL77839

SCHEMBL77839

Nc1nc2ccc(Cl)cc2s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.61
MAPT P10636 2/20 0.61
GAA P10253 2/20 0.61
HTT P42858 2/20 0.61
AXL P30530 1/20 0.61
GFER P55789 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
ALDH1A1 P00352 4/20 0.61
NPC1 O15118 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
KDM4E B2RXH2 2/20 0.61
LMNA P02545 2/20 0.61
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61
ALOX12 P18054 1/20 0.61
EPHX2 P34913 2/20 0.59
APP P05067 1/20 0.57
PI4KA P42356 3/20 0.56
PI4KB Q9UBF8 3/20 0.56
SCN4A P35499 2/20 0.56

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
Hydrochloric Acid SCHEMBL10831817 0.98 RAB9A (0.59) RAB9AMAPTGAAHTTAXL
Hydrochloric Acid SCHEMBL27769376 0.98 RAB9A (0.59) RAB9AMAPTGAAHTTAXL
Nitrogen SCHEMBL29238121 0.96 RAB9A (0.58) RAB9AMAPTGAAHTTAXL
Sulfuric Acid SCHEMBL9427700 0.90 ALDH1A1 (0.59) RAB9AMAPTGAAHTTAXL
SCHEMBL31114470 0.85 PIK3CA (0.73) RAB9AMAPTGAAHTTAXL
SCHEMBL9722748 0.85 PIK3CA (0.73) RAB9AMAPTGAAHTTAXL
SCHEMBL6707554 0.84 LMNA (0.71) RAB9AMAPTGAAHTTAXL
SCHEMBL29944901 0.84 LOXL2 (0.61) RAB9AMAPTGAAHTTAXL
SCHEMBL482340 0.84 LOXL2 (0.61) RAB9AMAPTGAAHTTAXL
SCHEMBL8129225 0.82 CYP3A4 (0.84) RAB9AMAPTGAAHTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119775273-A Riluzole/ciprofloxacin heterozygote and derivative thereof, and preparation method and application thereof 赣南医科大学第一附属医院 2025-04-08 CN claimed
EP-3758697-B1 NOVEL ANTIMYCOBACTERIAL HETEROCYCLIC AMIDES CRESTONE INC (US) 2024-10-16 EP claimed
CN-118772080-A Antimycobacterial heterocyclic amides 克莱斯通公司 2024-10-15 CN claimed
CN-112423746-B Novel antimycobacterial heterocyclic amides 克莱斯通公司 2024-06-28 CN claimed
CN-117843579-A Benzo heterocycle coupled catechol derivative and preparation method and application thereof 暨南大学 2024-04-09 CN claimed
CN-117683240-A Method for preparing iron-based MOFs by electron beam irradiation, iron-based MOFs and application 上海大学 2024-03-12 CN claimed
CN-117209448-A Process for the preparation of (benzo) thiazole-containing thio/selenoacetamides and derivatives thereof 济宁医学院 2023-12-12 CN claimed
CN-117126119-A Preparation method of (benzo) thiazole amide-containing compound 济宁医学院 2023-11-28 CN claimed
CN-113045993-A Polishing solution for processing ultra-smooth low-damage bearing steel surface and application thereof 西南交通大学 2021-06-29 CN claimed
CN-110143929-A A kind of preparation method of 2,6 '-dichlorobenzothiazoles 大连大学 2019-08-20 CN claimed
WO-1996018408-A1 HUMAN CANCER INHIBITORY PENTAPEPTIDE HETEROCYCLIC AND HALOPHENYL AMIDES ARIZONA BOARD OF REGENTS (US) 1996-06-20 WO claimed
EP-0282971-B1 Substituted 2-aminobenzothiazoles and derivatives useful as cerebrovascular agents WARNER LAMBERT CO (US) 1994-12-28 EP claimed
US-4826860-A STROKES WARNER-LAMBERT COMPANY (US) 1989-05-02 US claimed
EP-0282971-A2 Substituted 2-aminobenzothiazoles and derivatives useful as cerebrovascular agents WARNER-LAMBERT COMPANY (US) 1988-09-21 EP claimed
US-4496727-A ORGANIC PIGMENTS; PLASTICS; LACQUERS; INKS; COATINGS; COLOR FASTNESS CIBA-GEIGY CORPORATION (US) 1985-01-29 US claimed
US-4385174-A FOR PIGMENTS CIBA-GEIGY CORPORATION (US) 1983-05-24 US claimed
US-4363913-A Preparation of 2-aminobenzothiazoles EASTMAN KODAK COMPANY (US) 1982-12-14 US claimed
US-4349671-A Process for the production of metal complexes of isoindoline azines CIBA-GEIGY CORPORATION (US) 1982-09-14 US claimed
US-4288362-A Monoazo pigments containing a quinazo linonylacetoacetanilide coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-09-08 US claimed
US-4242495-A COATINGS, MOLDINGS, FOAMS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-12-30 US claimed