SCHEMBL28566356

SCHEMBL28566356

CC(=O)Nc1cc(Br)cc(C(=O)CO)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
LMNA P02545 2/20 0.43
RAB9A P51151 2/20 0.42
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 3/20 0.40
TP53 P04637 1/20 0.40
HIF1A Q16665 1/20 0.40
ACP1 P24666 1/20 0.39
NR4A1 P22736 1/20 0.39
NTSR1 P30989 1/20 0.39
ATM Q13315 1/20 0.39
KDM4E B2RXH2 1/20 0.38
GAA P10253 3/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 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
SCHEMBL6772321 0.81 MEN1 (0.53) POLBLMNARAB9AMEN1KMT2A
SCHEMBL16397403 0.81 MEN1 (0.53) POLBLMNARAB9AMEN1KMT2A
SCHEMBL11066401 0.80 ALDH1A1 (0.49) POLBLMNARAB9AMEN1KMT2A
SCHEMBL22864579 0.80 LMNA (0.58) LMNARAB9AMEN1KMT2AALDH1A1
SCHEMBL2070727 0.78 GSK3B (0.38) POLBRAB9AMEN1KMT2AALDH1A1
SCHEMBL9452430 0.76 LMNA (0.46) POLBLMNARAB9AMEN1KMT2A
SCHEMBL11073849 0.75 SMN1; SMN2 (0.54) POLBLMNAMEN1KMT2AALDH1A1
SCHEMBL909726 0.75 HDAC3 (0.58) POLBLMNARAB9AMEN1KMT2A
SCHEMBL24197589 0.73 LMNA (0.50) POLBLMNARAB9AMEN1KMT2A
SCHEMBL4111270 0.73 ALDH1A1 (0.70) RAB9AMEN1KMT2AALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107098822-B Preparation method for pranlukast key intermediate 3-amino-2-hydroxyacetophenone 上海微巨实业有限公司 2021-05-28 CN claimed
CN-107098822-B Preparation method for pranlukast key intermediate 3-amino-2-hydroxyacetophenone 上海微巨实业有限公司 2021-05-28 CN disclosed