SCHEMBL28860693

SCHEMBL28860693

CCCCCCCC(C(=O)O)c1c[nH]c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPT P10636 2/20 0.59
PKM P14618 1/20 0.59
GPR84 Q9NQS5 2/20 0.57
FFAR1 O14842 1/20 0.57
HDAC3 O15379 2/20 0.54
HDAC1 Q13547 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC10 Q969S8 2/20 0.54
HDAC11 Q96DB2 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
HDAC9 Q9UKV0 2/20 0.54
HDAC5 Q9UQL6 2/20 0.54
HDAC4 P56524 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
CTSK P43235 1/20 0.47
MTNR1A P48039 1/20 0.46
MGAM O43451 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
SCHEMBL21067833 0.95 MEN1 (0.61) MEN1KMT2AMAPTPKMGPR84
SCHEMBL4858383 0.95 MEN1 (0.61) MEN1KMT2AMAPTPKMGPR84
SCHEMBL20553142 0.89 GPR84 (0.68) MEN1KMT2AMAPTPKMGPR84
SCHEMBL4860329 0.89 GPR84 (0.68) MEN1KMT2AMAPTPKMGPR84
SCHEMBL28224613 0.86 HDAC3 (0.51) MEN1KMT2AMAPTPKMGPR84
SCHEMBL16634428 0.85 HDAC3 (0.55) MEN1KMT2AMAPTPKMGPR84
SCHEMBL6927648 0.84 MEN1 (0.48) MEN1KMT2AMAPTPKMGPR84
SCHEMBL1399657 0.84 KMT2A (0.58) MEN1KMT2AMAPTPKMGPR84
SCHEMBL18973743 0.84 MAPT (0.55) MEN1KMT2AMAPTPKMGPR84
SCHEMBL4979016 0.83 GPR84 (0.77) MEN1KMT2AMAPTGPR84FFAR1

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
CN-104936591-B Hematopoietin expression facilitator 国立大学法人东北大学 2018-05-29 CN disclosed