SCHEMBL29079378

SCHEMBL29079378

O=C(Cc1ccc(O)cc1)Nc1ccc(-c2ccccc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.81
KMT2A Q03164 3/20 0.81
BCHE P06276 3/20 0.68
ACHE P22303 3/20 0.68
RORC P51449 1/20 0.66
EPHX2 P34913 1/20 0.64
WNT3A P56704 1/20 0.61
DEGS1 O15121 1/20 0.59
NPC1 O15118 4/20 0.58
RAB9A P51151 3/20 0.58
ALDH1A1 P00352 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
MITF O75030 1/20 0.58
HTT P42858 1/20 0.58
LMNA P02545 2/20 0.58
PKM P14618 1/20 0.58
NR1H4 Q96RI1 1/20 0.57
PRMT1 Q99873 1/20 0.56
SLC6A2 P23975 1/20 0.56
SLC6A3 Q01959 1/20 0.56

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
SCHEMBL4420808 0.90 EPHX2 (0.79) MEN1KMT2ABCHEACHEEPHX2
SCHEMBL3714852 0.90 KMT2A (1.00) MEN1KMT2ABCHEACHERORC
SCHEMBL4420812 0.90 EPHX2 (0.79) MEN1KMT2ABCHEACHEEPHX2
SCHEMBL29167259 0.86 KMT2A (0.69) MEN1KMT2ABCHEACHEEPHX2
SCHEMBL1948079 0.85 KMT2A (0.83) MEN1KMT2ARORCEPHX2WNT3A
SCHEMBL8331684 0.83 MEN1 (0.79) MEN1KMT2ARORCEPHX2WNT3A
SCHEMBL1283623 0.83 KMT2A (0.79) MEN1KMT2ABCHEACHERORC
SCHEMBL19827071 0.83 MEN1 (0.73) MEN1KMT2ARORCEPHX2WNT3A
SCHEMBL10054999 0.82 EPHX2 (0.92) MEN1KMT2ABCHEACHEEPHX2
SCHEMBL5197660 0.82 MEN1 (0.72) MEN1KMT2ARORCEPHX2WNT3A

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
CN-117417279-A Phenoxyacetic acid compound, isomer thereof, pharmaceutically acceptable salt or solvate thereof, pharmaceutical composition and medical application 中国人民解放军军事科学院军事医学研究院 2024-01-19 CN disclosed
CN-116803977-A Preparation method and application of phenoxyacetic acid derivative 中国人民解放军军事科学院军事医学研究院 2023-09-26 CN disclosed