SCHEMBL29773843

SCHEMBL29773843

CC(C)(C)OC(=O)n1c2ccccc2c2c(-c3cccnc3)nccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 1/20 0.44
▸ KIT P10721 1/20 0.40
▸ GPR119 Q8TDV5 2/20 0.39
▸ TTK P33981 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ GABRG2 P18507 2/20 0.39
▸ GABRB3 P28472 2/20 0.39
▸ GABRA5 P31644 2/20 0.39
▸ CHRM2 P08172 1/20 0.38
▸ CHRM4 P08173 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ CHRM3 P20309 1/20 0.38
▸ TDO2 P48775 1/20 0.37
▸ GABRA1 P14867 1/20 0.37
▸ GABRA2 P47869 1/20 0.37
▸ GABRA6 Q16445 1/20 0.37
▸ PDK2 Q15119 1/20 0.36
▸ CKS1B P61024 1/20 0.36
▸ SKP1 P63208 1/20 0.36
▸ SKP2 Q13309 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
SCHEMBL27905858 0.85 GBA1 (0.44) GBA1KITGPR119TTKHTT
SCHEMBL20581175 0.83 FYN (0.40) GBA1KITGPR119TTK
SCHEMBL20580553 0.80 PDPK1 (0.46) CYP11B2
SCHEMBL18437189 0.79 KIT (0.41) GBA1KITGPR119TTKHTT
SCHEMBL18478247 0.79 KIT (0.41) GBA1KITGPR119TTKHTT
SCHEMBL29773883 0.78 CHRM2 (0.49) GBA1GPR119GABRG2GABRB3GABRA5
SCHEMBL29057628 0.77 MAP2K4 (0.50) GBA1KITGPR119HTTCYP11B2
SCHEMBL29773852 0.75 CYP11B2 (0.55) GABRG2GABRB3GABRA5TDO2GABRA1
SCHEMBL27905863 0.75 CHRM2 (0.49) GBA1GPR119GABRG2GABRB3GABRA5
SCHEMBL30022454 0.73 CHRM2 (0.59) GPR119HTTGABRG2GABRB3GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954801-A TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-05-09 — — CN disclosed
CN-114867727-B TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2025-02-21 — — CN disclosed
CN-114867727-A TAU protein targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2022-08-05 — — CN disclosed
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