SCHEMBL30848637

SCHEMBL30848637

C[Si](C)(C)C#Cc1cccc2c1C(=O)c1ccccc1C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.47
CES1 P23141 2/20 0.41
BCHE P06276 1/20 0.41
ALDH1A1 P00352 5/20 0.40
ACHE P22303 2/20 0.38
CYP19A1 P11511 2/20 0.38
TNF P01375 2/20 0.38
KDM4E B2RXH2 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CREBBP Q92793 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 3/20 0.36
USP2 O75604 1/20 0.36
HPN P05981 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX5 P09917 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL29269175 0.80 MAPT (0.45) MAOAALDH1A1KDM4EMEN1KMT2A
SCHEMBL15143410 0.80 AKR1B1 (0.37) ALDH1A1ACHEMEN1KMT2ACREBBP
SCHEMBL28571180 0.77 MAOA (0.55) MAOACES1BCHEALDH1A1ACHE
SCHEMBL6847083 0.76 PNMT (0.42) MAOABCHEALDH1A1ACHEKDM4E
SCHEMBL769934 0.74 MAOA (0.71) MAOACES1BCHEALDH1A1ACHE
SCHEMBL20791596 0.72 MAPT (0.40) ALDH1A1KDM4EMEN1KMT2ACREBBP
SCHEMBL2810259 0.72 CREBBP (0.39) ALDH1A1KDM4EMEN1KMT2ACREBBP
SCHEMBL4652610 0.72 MAOA (0.61) MAOACES1BCHEALDH1A1ACHE
SCHEMBL30177232 0.72 MAOA (0.61) MAOACES1BCHEALDH1A1ACHE
SCHEMBL12478975 0.71 AURKA (0.44) CREBBPKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4578256-A1 ORGANIC LAYER COMPRISING REGIONS HAVING DIFFERENT ELECTRONIC PROPERTIES Fondazione Istituto Italiano di Tecnologia (IT) 2025-07-02 EP disclosed
WO-2024042491-A1 ORGANIC LAYER COMPRISING REGIONS HAVING DIFFERENT ELECTRONIC PROPERTIES FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2024-02-29 WO disclosed