SCHEMBL23802411

SCHEMBL23802411

CCOC(=O)Oc1ccc(C(=O)CC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
SMN1; SMN2 Q16637 5/20 0.51
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
ALDH1A1 P00352 3/20 0.51
MAPT P10636 4/20 0.49
KDM4E B2RXH2 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ESR1 P03372 1/20 0.47
RECQL P46063 1/20 0.47
HIF1A Q16665 1/20 0.47
HRH2 P25021 1/20 0.47
HRH1 P35367 1/20 0.47
HDAC3 O15379 2/20 0.46
HDAC4 P56524 2/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC7 Q8WUI4 2/20 0.46
HDAC2 Q92769 2/20 0.46
HDAC10 Q969S8 2/20 0.46
HDAC11 Q96DB2 2/20 0.46

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
SCHEMBL6451238 0.87 ALDH1A1 (0.55) KMT2ASMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL14475394 0.86 GSK3B (0.46) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL26802703 0.84 KMT2A (0.58) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL3789020 0.84 HSD17B10 (0.53) KMT2ASMN1; SMN2ALDH1A1MAPTMMP2
SCHEMBL929726 0.82 KMT2A (0.45) KMT2ASMN1; SMN2ALDH1A1ESR1RECQL
SCHEMBL1598705 0.81 LMNA (0.57) KMT2ASMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL8983109 0.81 KMT2A (0.46) KMT2ASMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL22247015 0.80 KMT2A (0.44) KMT2ASMN1; SMN2RAB9ANPC1MAPT
SCHEMBL11390053 0.79 ELANE (0.58) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL6894576 0.79 GAA (0.51) KMT2AALDH1A1KDM4EHDAC3HDAC4

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