SCHEMBL17787294

SCHEMBL17787294

CC(=O)NCc1ccc(C(=O)ON2C(=O)CCC2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
HDAC1 Q13547 7/20 0.50
HDAC6 Q9UBN7 2/20 0.50
ALDH1A1 P00352 2/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
HDAC3 O15379 6/20 0.44
HDAC2 Q92769 6/20 0.44
HDAC8 Q9BY41 5/20 0.41
HDAC4 P56524 2/20 0.41
HDAC11 Q96DB2 2/20 0.41
HDAC7 Q8WUI4 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
SLC1A2 P43004 1/20 0.40
HTT P42858 1/20 0.39
HPGD P15428 1/20 0.39
HTR2A P28223 1/20 0.39

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
SCHEMBL9715241 0.84 F2 (0.38) MAPTSLC1A2HTT
SCHEMBL130859 0.83 NAMPT (0.47) KMT2AHDAC1HDAC6MAPTHDAC10
SCHEMBL26169637 0.83 EPHX2 (0.40) KMT2AHDAC6POLBMAPTSLC1A2
SCHEMBL26167885 0.82 ADRB2 (0.41) KMT2AHDAC6ALDH1A1RAB9ASLC1A2
SCHEMBL17071632 0.82 ALDH1A1 (0.47) KMT2AALDH1A1POLBRAB9AHPGD
SCHEMBL20278536 0.81 POLB (0.41) KMT2AALDH1A1POLBHPGD
SCHEMBL26167881 0.81 P2RX7 (0.40)
SCHEMBL300884 0.80 CA12 (0.42) KMT2AALDH1A1MAPTRAB9AHPGD
SCHEMBL9743869 0.79 HPGD (0.38) KMT2AALDH1A1RAB9AHPGD
SCHEMBL14049559 0.79 RAB9A (0.40) KMT2AALDH1A1MAPTRAB9AHTT

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-20230160001-A1 NUCLEOTIDE CLEAVABLE LINKERS WITH RIGID SPACERS AND USES THEREOF FIRST-CITIZENS BANK & TRUST COMPANY 2023-05-25 US disclosed
US-9354234-B2 Multi-fluorescent substance including novel coumarin derivative, and LED light source-based microfluorescent quantitative biosensor for diagnosis using same GENBODY INC. (KR) 2016-05-31 US disclosed
US-9354234-B2 Multi-fluorescent substance including novel coumarin derivative, and LED light source-based microfluorescent quantitative biosensor for diagnosis using same GENBODY INC. (KR) 2016-05-31 US disclosed