SCHEMBL21711263

SCHEMBL21711263

COc1cc(Br)ccc1C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.40
GAA P10253 1/20 0.38
SIK1 P57059 1/20 0.38
SIK2 Q9H0K1 1/20 0.38
SIK3 Q9Y2K2 1/20 0.38
ALDH1A1 P00352 5/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38
TUBB3 Q13509 1/20 0.38
TUBB2A Q13885 1/20 0.38
TUBB8 Q3ZCM7 1/20 0.38
TUBA3E Q6PEY2 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
SCHEMBL24172856 0.81 HPGD (0.40) RAB9AGAAALDH1A1KMT2AMEN1
SCHEMBL3870236 0.80 SMN1; SMN2 (0.48) GAAALDH1A1KMT2ASMN1; SMN2HPGD
SCHEMBL7285310 0.80 HTT (0.48) GAAALDH1A1KMT2AMEN1HPGD
SCHEMBL29827082 0.77 NR4A2 (0.51) RAB9AGAAALDH1A1KMT2ASMN1; SMN2
SCHEMBL257244 0.77 NR4A2 (0.51) RAB9AGAAALDH1A1KMT2ASMN1; SMN2
SCHEMBL4733762 0.75 MAPT (0.49) RAB9AALDH1A1KMT2AMEN1HPGD
SCHEMBL9349733 0.74 MAPT (0.37) RAB9AALDH1A1KMT2AMEN1HPGD
SCHEMBL4805409 0.73 GAA (0.63) GAAALDH1A1KMT2AMEN1
SCHEMBL11038736 0.72 TSHR (0.53) RAB9AGAAALDH1A1KMT2ASMN1; SMN2
SCHEMBL1800956 0.72 PTPRF (0.44) RAB9AALDH1A1SMN1; SMN2HPGDMAPT

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
US-20200050107-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-02-13 US disclosed