SCHEMBL21706301

SCHEMBL21706301

CCC(Cc1ccccc1)(C(=O)c1ccc(OC)c(O)c1)N(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.45
BCHE P06276 5/20 0.45
EGFR P00533 2/20 0.42
HTT P42858 1/20 0.42
GAA P10253 2/20 0.42
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
SRC P12931 1/20 0.41
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40
TUBB4B P68371 1/20 0.40
TUBB3 Q13509 1/20 0.40
TUBB2A Q13885 1/20 0.40

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
SCHEMBL29421022 0.91 ACHE (0.53) ACHEBCHEHTTRAB9ANPC1
SCHEMBL480430 0.91 ACHE (0.53) ACHEBCHEHTTRAB9ANPC1
SCHEMBL8776056 0.85 ACHE (0.42) ACHEBCHEHTTRAB9ANPC1
SCHEMBL8898433 0.83 OPRM1 (0.53) ACHEBCHEHTTHPGDSMN1; SMN2
SCHEMBL8176376 0.83 HPGD (0.47) ACHEBCHERAB9ANPC1HPGD
SCHEMBL8179111 0.82 HPGD (0.46) ACHEBCHERAB9ANPC1HPGD
SCHEMBL8175821 0.82 HPGD (0.46) ACHEBCHEHTTRAB9ANPC1
SCHEMBL4651504 0.82 ACHE (0.51) ACHEHTTRAB9ANPC1HPGD
SCHEMBL9315365 0.81 ACHE (0.51) ACHEBCHERAB9ANPC1HPGD
SCHEMBL4652464 0.81 ACHE (0.47) ACHEBCHEHTTHPGDSMN1; SMN2

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
US-11001698-B2 Stabilizer composition BASF SE 2021-05-11 US disclosed
US-20200048394-A1 HARDENABLE POLYMER COMPOSITION BASF SE (DE) 2020-02-13 US disclosed
US-20200048431-A1 STABILIZER COMPOSITION BASF SE (DE) 2020-02-13 US disclosed