SCHEMBL28840307

SCHEMBL28840307

Cc1cc(Br)ccc1C(=O)NCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 3/20 0.51
RAB9A P51151 3/20 0.50
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
KMT2A Q03164 2/20 0.47
HPGD P15428 1/20 0.47
GPR27 Q9NS67 1/20 0.46
POLB P06746 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
HIF1A Q16665 1/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 2/20 0.43

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
SCHEMBL3658275 0.83 FLT1 (0.50) RAB9AFLT1FLT4KDRKMT2A
SCHEMBL15630996 0.83 EGLN1 (0.61) EGLN1RAB9AFLT1FLT4KDR
SCHEMBL29175526 0.82 ALDH1A1 (0.55) RAB9AFLT1FLT4KDRKMT2A
SCHEMBL2800276 0.81 SMN1; SMN2 (0.50) RAB9AFLT1FLT4KDRKMT2A
SCHEMBL31536402 0.81 EGLN1 (0.51) EGLN1RAB9AKMT2APOLBTDP1
SCHEMBL10528953 0.81 KDM4E (0.60) EGLN1RAB9AKMT2APOLBTDP1
SCHEMBL8419993 0.81 EGLN1 (0.51) EGLN1RAB9AKMT2APOLBTDP1
SCHEMBL21412050 0.80 ALDH1A1 (0.55) EGLN1RAB9AKMT2AHPGDGPR27
SCHEMBL20145565 0.80 HPGD (0.74) RAB9AKMT2AHPGDKDM4ESMN1; SMN2
SCHEMBL28839786 0.80 FLT1 (0.42) FLT1FLT4KDRKMT2AHPGD

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-114907236-B Aldoxime compound and preparation method and application thereof 四川青木制药有限公司 2024-02-09 CN disclosed
CN-114907236-A Aldoxime compound and preparation method and application thereof 四川青木制药有限公司 2022-08-16 CN disclosed