SCHEMBL394477

SCHEMBL394477

Cc1cc(C)n[c]n1

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
SCHEMBL896562 0.76
SCHEMBL10562467 0.76
SCHEMBL1586811 0.74 HSP90AA1 (0.45)
SCHEMBL3381566 0.69
SCHEMBL17666190 0.63
SCHEMBL8892707 0.63
SCHEMBL196024 0.59
SCHEMBL8684598 0.59
SCHEMBL161508 0.59
SCHEMBL16154429 0.59 POLB (0.53)

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 1001 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11987588-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of heart failure and disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2024-05-21 US claimed
WO-2024024962-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC RING DERIVATIVE 住友ファーマ株式会社 2024-02-01 WO claimed
CN-114656462-B N-containing heterocyclic aromatic hydrazone derivatives, and preparation method and application thereof 南开大学 2023-12-19 CN claimed
US-20230391808-A1 PHOSPHAPHENALENE-GOLD(I) COMPLEXES AS CHEMOTHERAPEUTIC AGENTS AGAINST GLIOBLASTOMA UNIVERSITY OF CASTILLA-LA-MANCHA (ES) 2023-12-07 US claimed
EP-3720858-B1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF HEART FAILURE AND DISORDERS RELATED THERETO ARENA PHARM INC (US) 2023-06-07 EP claimed
US-11667644-B2 Disubstituted octahydropyrrolo[3,4-c]pyrroles as orexin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2023-06-06 US claimed
CN-109694350-B Compound containing fluoromethyl and preparation method thereof 中国科学院上海有机化学研究所 2023-05-09 CN claimed
US-11528907-B2 Heteroaryl-triazole and heteroaryl-tetrazole compounds as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2022-12-20 US claimed
US-20220396579-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF HEART FAILURE AND DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. 2022-12-15 US claimed
WO-2022243574-A1 3-(PHTHALAZIN-1-YL)BENZENESULFONAMIDE-BASED SLC16A3 INHIBITORS AND THEIR THERAPEUTIC USE CEMM - FORSCHUNGSZENTRUM FÜR MOLEKULARE MEDIZIN GMBH (AT) 2022-11-24 WO claimed
EP-0154528-A2 Alkene, alkyne or cycloalkylene derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-09-11 EP claimed
EP-0150984-A2 6-(Substituted) methylenepenicillanic and 6-(substituted) hydroxymethylpenicillanic acids and derivatives thereof PFIZER INC. (US) 1985-08-07 EP claimed
EP-0132230-A2 Process for the preparation of sulfonyl urea CIBA-GEIGY AG (CH) 1985-01-23 EP claimed
EP-0031796-B1 4-HETEROCYCLYL-4'-VINYL-STILBENES CIBA-GEIGY AG (CH) 1985-01-23 EP claimed
EP-0096004-A2 Sulfonyl(thio)ureas, process for their preparation and their use as herbicides and/or growth regulating agents CIBA-GEIGY AG (CH) 1983-12-07 EP claimed
US-4366189-A WHITENERS CIBA-GEIGY CORPORATION (US) 1982-12-28 US claimed
US-4332796-A MICROCRYSTALS COATED WITH MIXTURES OF PHOSPHOLIPIDS AND NONIONIC SURFACTANTS LABORATORIOS BAGO S.A. (AR) 1982-06-01 US claimed
US-4323569-A β-Lactam anti-bacterial, compositions containing them and a process for their preparation BEECHAM GROUP LIMITED (GB) 1982-04-06 US claimed
EP-0008514-B1 BETA-LACTAM ANTI-BACTERIALS, COMPOSITIONS CONTAINING THEM AND A PROCESS FOR THEIR PREPARATION BEECHAM GROUP PLC (GB) 1982-01-20 EP claimed
EP-0008514-A1 Beta-lactam anti-bacterials, compositions containing them and a process for their preparation BEECHAM GROUP PLC (GB) 1980-03-05 EP claimed