SCHEMBL29470575

SCHEMBL29470575

CCC(=O)c1cc(O)c2c(c1)OCO2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
HPGD P15428 3/20 0.42
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ABCB1 P08183 1/20 0.39
CYP3A4 P08684 2/20 0.38
MAPT P10636 2/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38

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
SCHEMBL6066738 0.80 RAB9A (0.51) HPGDALDH1A1MEN1KMT2AHTT
SCHEMBL5743163 0.80 CYP3A4 (0.55) ATMALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL1811267 0.80 ALDH1A1 (0.55) HPGDALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL29901789 0.77 KDM4E (0.53) ATMHPGDALDH1A1MEN1KMT2A
SCHEMBL9512531 0.77 KDM4E (0.53) ATMHPGDALDH1A1MEN1KMT2A
SCHEMBL29639737 0.75 ATM (0.81) ATMHPGDALDH1A1MEN1KMT2A
SCHEMBL1092123 0.75 ATM (0.81) ATMHPGDALDH1A1MEN1KMT2A
SCHEMBL16369471 0.73 ATM (0.63) ATMHPGDALDH1A1MEN1KMT2A
SCHEMBL12121972 0.73 CYP3A4 (0.45) ATMALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL28568470 0.71 KDM4E (0.50) ATMHPGDALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117658866-A Synthesis method of azido amino acid derivative 苏州爱玛特生物科技有限公司 2024-03-08 CN disclosed
CN-115840259-A Satellite load efficiency evaluation method, device, equipment and readable storage medium 北京跟踪与通信技术研究所 2023-03-24 CN disclosed
CN-114498751-A Renewable energy power generation-based method for determining multi-energy stability of outgoing power grid 国网内蒙古东部电力有限公司 2022-05-13 CN disclosed
CN-114379338-A Occupant light exposure detection 福特全球技术公司 2022-04-22 CN disclosed