SCHEMBL4624522

SCHEMBL4624522

C1=Cc2cnccc2C1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4624876 0.82
SCHEMBL23656184 0.81 SIGMAR1 (0.34)
SCHEMBL3656009 0.78 SIGMAR1 (0.43)
SCHEMBL30027858 0.75 SIGMAR1 (0.41)
SCHEMBL23470344 0.75 SIGMAR1 (0.36)
SCHEMBL19605733 0.75 SIGMAR1 (0.50)
Isoquinoline SCHEMBL28392791 0.74 CA1 (0.39)
Isoquinoline SCHEMBL1308876 0.74 CA1 (0.39)
Isoquinoline SCHEMBL1310260 0.74 CA1 (0.39)
SCHEMBL14965050 0.73 SIGMAR1 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3617198-B1 GUANIDINE DERIVATIVE LUNAN PHARMACEUTICAL GROUP CORP (CN) 2023-10-25 EP claimed
EP-1792605-A1 Use of at least a cationic cyanine derivative for use in hair dyeing, composition containg it process of treating keratinic fibres using the same composition, kit and use thereof L'Oréal (FR) 2007-06-06 EP claimed
EP-4448526-A1 PYRAZOLOPYRAZINE COMPOUNDS AS SHP2 INHIBITORS GENZYME CORPORATION (US) 2024-10-23 EP disclosed
US-20240270759-A1 Preparation of SHP2 phosphatase inhibitors and its applications YA THERAPEUTICS INC (CN) 2024-08-15 US disclosed
US-11912714-B2 Spiropyrrolidine derived antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2024-02-27 US disclosed
US-11858945-B2 Alkyne-containing antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2024-01-02 US disclosed
US-20230365525-A1 ANTIVIRAL COMPOUNDS ENANTA PHARMACEUTICALS, INC. 2023-11-16 US disclosed
US-11809079-B2 Photosensitive resin composition, polyimide production method, and semiconductor device ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-11-07 US disclosed
EP-3617198-B1 GUANIDINE DERIVATIVE LUNAN PHARMACEUTICAL GROUP CORP (CN) 2023-10-25 EP disclosed
US-20230331673-A1 COMPOSITION OF COMPOUNDS THAT MODULATE CELL METABOLISM AND METHODS OF USE CRESCENTA BIOSCIENCES (US) 2023-10-19 US disclosed
US-20230331734-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2023-10-19 US disclosed
EP-0327239-B1 1-carbacephalosporin antibiotics LILLY CO ELI (US) 1994-06-22 EP disclosed
US-5019571-A 1-carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1991-05-28 US disclosed
US-5011938-A Antimicrobials ELI LILLY AND COMPANY (US) 1991-04-30 US disclosed
US-4940718-A BACTERICIDES ELI LILLY AND COMPANY (US) 1990-07-10 US disclosed
US-4902707-A Bicyclic pyrazolidinones, compositions and use ELI LILLY AND COMPANY (US) 1990-02-20 US disclosed
EP-0327239-A1 1-carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1989-08-09 EP disclosed
EP-0203722-A1 Bicyclic pyrazolidinones ELI LILLY AND COMPANY (US) 1986-12-03 EP disclosed
EP-0202046-A1 7-Substituted bicyclic pyrazolidinones ELI LILLY AND COMPANY (US) 1986-11-20 EP disclosed
CN-86102877-A The method for preparing bicyclic pyrazolidinones 1986-10-29 CN disclosed