SCHEMBL29045583

SCHEMBL29045583

COC(=O)c1cc(-c2ccccc2)cc(-c2ccccc2)c1C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.53
ALDH1A1 P00352 5/20 0.53
KMT2A Q03164 5/20 0.53
MAPT P10636 5/20 0.53
TDP1 Q9NUW8 2/20 0.53
RECQL P46063 1/20 0.53
HTT P42858 1/20 0.51
LMNA P02545 3/20 0.50
GABRA1 P14867 2/20 0.50
GABRG2 P18507 2/20 0.50
GABRB3 P28472 2/20 0.50
GABRA3 P34903 2/20 0.50
HPGD P15428 2/20 0.50
PTPN1 P18031 1/20 0.50
PRKCZ Q05513 1/20 0.50
EGFR P00533 1/20 0.50
SLC6A3 Q01959 4/20 0.49
GABRA5 P31644 1/20 0.49
PPARG P37231 2/20 0.47
NCOR2 Q9Y618 2/20 0.47

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
SCHEMBL3576573 0.85 MEN1 (0.58) MEN1ALDH1A1KMT2AMAPTTDP1
SCHEMBL17459525 0.84 HTT (0.55) MEN1ALDH1A1KMT2AMAPTTDP1
SCHEMBL29042677 0.81 GABRA1 (0.54) MEN1ALDH1A1KMT2AMAPTTDP1
SCHEMBL69682 0.80 SLC6A3 (0.57) MEN1ALDH1A1KMT2AMAPTTDP1
SCHEMBL27386788 0.80 EGFR (0.65) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL28726425 0.80 TSHR (0.53) MEN1ALDH1A1KMT2AMAPTLMNA
SCHEMBL12121707 0.79 GABRA1 (0.62) MEN1ALDH1A1KMT2AMAPTTDP1
SCHEMBL17459507 0.79 HTT (0.50) MEN1ALDH1A1KMT2AMAPTHTT
SCHEMBL27516914 0.78 ALDH1A1 (0.58) MEN1ALDH1A1KMT2AMAPTTDP1
SCHEMBL11323927 0.77 EGFR (0.54) MEN1ALDH1A1KMT2AMAPTTDP1

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
CN-116520653-A Charge regulator and preparation method and application thereof 邯郸汉光办公自动化耗材有限公司 2023-08-01 CN disclosed