SCHEMBL481885

SCHEMBL481885

CC(C)[Si](Oc1ccc(Br)cc1)(C(C)C)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
LDHA P00338 1/20 0.36
CYP2A6 P11509 1/20 0.36
LMNA P02545 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
ALDH1A1 P00352 4/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33

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
SCHEMBL13347413 0.89 CHRNA7 (0.42) MAPTRAB9AMEN1MAPK1KMT2A
SCHEMBL190598 0.82 NCEH1 (0.47) MAPTCYP2A6LMNATDP1RAB9A
SCHEMBL13043497 0.79 ACHE (0.44) MAPTLMNATDP1RAB9AMEN1
SCHEMBL3085551 0.78 TRPA1 (0.36) ALDH1A1SLC6A4
SCHEMBL3937179 0.77 GABRA1 (0.32)
SCHEMBL198322 0.77 L3MBTL1 (0.41) MAPTCYP2A6LMNARAB9AMEN1
SCHEMBL15974368 0.77
SCHEMBL20594015 0.77
SCHEMBL7354814 0.77 APP (0.35) CA1CA2CA9SLC6A4
SCHEMBL15974976 0.77 ESR2 (0.44) MAPTLMNARAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111808006-B Nitrogen heterocyclic ring allyl compound and preparation method and application thereof 暨南大学 2023-04-07 CN claimed
CN-111808006-A Nitrogen heterocyclic ring allyl compound and preparation method and application thereof 暨南大学 2020-10-23 CN claimed
WO-2023248253-A1 A NEW LIGAND SCAFFOLD (PY-PYRI) FOR THE META BORYLATION OF PHENOL DERIVATIVES CENTRE OF BIOMEDICAL RESEARCH (IN) 2023-12-28 WO disclosed
CN-114516789-B Cyclopropenones micromolecule compound and synthetic method and application thereof 暨南大学 2023-12-05 CN disclosed
CN-111808006-B Nitrogen heterocyclic ring allyl compound and preparation method and application thereof 暨南大学 2023-04-07 CN disclosed
CN-114516789-A Cyclopropenone micromolecule compound and synthetic method and application thereof 暨南大学 2022-05-20 CN disclosed
CN-111808006-A Nitrogen heterocyclic ring allyl compound and preparation method and application thereof 暨南大学 2020-10-23 CN disclosed
US-9978473-B2 Doping methods for hole injection and transport layers NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-05-22 US disclosed
US-9978473-B2 Doping methods for hole injection and transport layers NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-05-22 US disclosed
EP-2457913-B1 Heteroaryl compounds, compositions thereof, and methods of treatment therewith SIGNAL PHARM LLC (US) 2017-04-19 EP disclosed
EP-2090577-B1 Heteroaryl compounds, compositions thereof, and their use as protein kinase inhibitors SIGNAL PHARM LLC (US) 2017-04-05 EP disclosed
US-6025382-A Antithrombotic diamines ELI LILLY AND COMPANY (US) 2000-02-15 US disclosed
EP-0973517-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-01-26 EP disclosed
WO-1999045927-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-09-16 WO disclosed
EP-0863755-A4 ANTITHROMBOTIC DIAMINES LILLY CO ELI (US) 1999-01-20 EP disclosed
WO-1998048798-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 WO disclosed
WO-1998048794-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 WO disclosed
WO-1998048804-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 WO disclosed
EP-0863755-A1 ANTITHROMBOTIC DIAMINES ELI LILLY AND COMPANY (US) 1998-09-16 EP disclosed
WO-1997025033-A1 ANTITHROMBOTIC DIAMINES ELI LILLY AND COMPANY (US) 1997-07-17 WO disclosed