SCHEMBL28613401

SCHEMBL28613401

O=C1C(CCCl)CCN1Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
ALDH1A1 P00352 1/20 0.44
EHMT2 Q96KQ7 1/20 0.44
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 2/20 0.42
POLB P06746 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MEN1 O00255 1/20 0.42
CCR3 P51677 1/20 0.41

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
SCHEMBL6733710 0.87 HSD11B1 (0.57) HSD11B1HDAC1HDAC8HDAC6ALDH1A1
SCHEMBL7278801 0.83 HDAC1 (0.48) HDAC1HDAC8HDAC6ALDH1A1EHMT2
SCHEMBL9461582 0.83 HDAC1 (0.45) HSD11B1HDAC1HDAC8HDAC6ALDH1A1
SCHEMBL837205 0.82 HDAC1 (0.44) HDAC1HDAC8HDAC6ALDH1A1EHMT2
SCHEMBL8965454 0.82 SLC6A2 (0.45) HDAC1HDAC8HDAC6ALDH1A1
SCHEMBL23364678 0.82 ALDH1A1 (0.43) HDAC1HDAC8HDAC6ALDH1A1EHMT2
SCHEMBL21245020 0.81 MEN1 (0.43) HDAC1HDAC8HDAC6ALDH1A1EHMT2
SCHEMBL17647438 0.81 HDAC1 (0.44) HDAC1HDAC8HDAC6ALDH1A1EHMT2
SCHEMBL14177598 0.80 HSD11B1 (0.53) HSD11B1L3MBTL1KMT2APOLBMEN1
SCHEMBL14618383 0.79 HDAC1 (0.39) HDAC1HDAC8HDAC6ALDH1A1EHMT2

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-112479967-A Biliverdin compound and preparation method and application thereof 百顺药业有限公司 2021-03-12 CN disclosed