SCHEMBL23801336

SCHEMBL23801336

CCC(=O)c1ccc(OC(=O)N(CC)CC)cc1

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.76
▸ MEN1 O00255 1/20 0.76
▸ SMN1; SMN2 Q16637 4/20 0.61
▸ RAB9A P51151 3/20 0.61
▸ NPC1 O15118 2/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ HSD17B10 Q99714 1/20 0.58
▸ LMNA P02545 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ MAOA P21397 2/20 0.49
▸ SRD5A1 P18405 1/20 0.48
▸ MAPT P10636 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ ESR1 P03372 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ HPGD P15428 1/20 0.44
▸ ABCB1 P08183 1/20 0.44

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
SCHEMBL9302685 0.87 MEN1 (1.00) KMT2AMEN1SMN1; SMN2RAB9AHSD17B10
SCHEMBL1495914 0.84 MEN1 (0.79) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL5623889 0.82 MEN1 (0.88) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL8945322 0.80 KMT2A (0.85) KMT2AMEN1SMN1; SMN2RAB9AALDH1A1
SCHEMBL10013782 0.79 MEN1 (0.81) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL19439086 0.79 MEN1 (0.81) KMT2AMEN1SMN1; SMN2RAB9AALDH1A1
SCHEMBL12928357 0.79 MEN1 (0.81) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL2531879 0.79 MEN1 (0.81) KMT2AMEN1SMN1; SMN2RAB9AHSD17B10
SCHEMBL8945706 0.79 MEN1 (0.81) KMT2AMEN1SMN1; SMN2RAB9AHSD17B10
SCHEMBL11390053 0.78 ELANE (0.58) KMT2AMEN1SMN1; SMN2RAB9ANPC1

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
WO-2021175855-A1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2021-09-10 — — WO disclosed
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