SCHEMBL6565816

SCHEMBL6565816

CC(C)(C)c1cc(CCC2CCCC2)cc(C(C)(C)C)c1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLRA3 O75311 1/20 0.41
▸ GLRB P48167 1/20 0.41
▸ DAO P14920 2/20 0.40
▸ MAOB P27338 3/20 0.38
▸ MAOA P21397 2/20 0.38
▸ ACHE P22303 1/20 0.38
▸ GAA P10253 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ TBK1 Q9UHD2 3/20 0.35
▸ PPM1D O15297 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ THRA P10827 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL19677849 0.81 ALDH1A1 (0.49) DAOMAOBMAOAACHEGAA
SCHEMBL19677863 0.78 ALDH1A1 (0.49) MAOBMAOAACHEGAAMEN1
SCHEMBL19328863 0.77 DAO (0.48) DAOTBK1PPM1DTHRATHRB
SCHEMBL27975645 0.76 DAO (0.45) DAOKMT2ATBK1PPM1DTHRA
SCHEMBL28088975 0.76 GAA (0.47) GLRA3GLRBGAAMEN1KMT2A
SCHEMBL28138572 0.74 DAO (0.48) DAOKMT2ATBK1PPM1DTHRA
SCHEMBL19677860 0.74 ALDH1A1 (0.51) MAOBMAOAACHEGAAMEN1
SCHEMBL27685489 0.73 GLRA3 (0.52) GLRA3GLRBGAAMEN1KMT2A
SCHEMBL8342112 0.72 KAT8 (0.48) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL8533243 0.72 GLRA3 (0.47) GLRA3GLRBGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1186630-B1 Organohybrid-based damping material containing a damping improver and production method MASAO SUMITA (JP) 2004-02-04 — — EP claimed
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