SCHEMBL17744827

SCHEMBL17744827

NNc1c(C(=O)O)cccc1-c1cccc(N)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.51
HNF4A P41235 1/20 0.42
MAOA P21397 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 3/20 0.41
THRB P10828 2/20 0.41
RECQL P46063 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
USP2 O75604 1/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
APEX1 P27695 1/20 0.41
BLM P54132 1/20 0.41
UCHL5 Q9Y5K5 1/20 0.41
MAP4K4 O95819 1/20 0.41
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
HPGD P15428 2/20 0.40
FABP3 P05413 1/20 0.40

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
SCHEMBL29155698 0.82 MCL1 (0.58) MCL1HNF4AMAOAMEN1KMT2A
SCHEMBL30690111 0.82 MCL1 (0.58) MCL1HNF4AMAOAMEN1KMT2A
Hydrochloric Acid SCHEMBL28414121 0.81 HNF4A (0.67) MCL1HNF4AMAOAMEN1KMT2A
SCHEMBL17744897 0.81 MCL1 (0.57) MCL1HNF4AMAOAMEN1KMT2A
SCHEMBL28367654 0.80 MCL1 (0.55) MCL1HNF4AMAOAMEN1KMT2A
SCHEMBL6852742 0.80 HNF4A (0.69) MCL1HNF4AMAOAMEN1KMT2A
SCHEMBL17744823 0.79 MCL1 (0.51) MCL1MAOAMEN1KMT2AMAPT
SCHEMBL17744801 0.76 MMP2 (0.49) MCL1HNF4AMEN1KMT2AMAPT
SCHEMBL725315 0.76 ALDH1A1 (0.52) MAPTTDP1POLBALDH1A1HPGD
SCHEMBL17744893 0.76 MCL1 (0.51) MCL1HNF4AMAOAMEN1KMT2A

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
US-20160152785-A1 EPOXY RESIN COMPOSITION, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES, INC. (JP) 2016-06-02 US disclosed
EP-3020763-A1 EPOXY RESIN COMPOSITION, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL Toray Industries, Inc. (JP) 2016-05-18 EP disclosed