SCHEMBL23401112

SCHEMBL23401112

CCc1c(O)nn(-c2ccc(C)cc2)c1-c1ccccc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
TSHR P16473 2/20 0.39
DCTPP1 Q9H773 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
HIF1A Q16665 3/20 0.38
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 2/20 0.35
USP2 O75604 2/20 0.35
ALDH1A1 P00352 2/20 0.35
GAA P10253 1/20 0.35
TP53 P04637 2/20 0.34
ALOX15 P16050 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
GMNN O75496 1/20 0.34
ESR1 P03372 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL23399201 0.92 LMNA (0.47) LMNATSHRDCTPP1KMT2AMEN1
SCHEMBL23400060 0.90 LMNA (0.43) LMNATSHRDCTPP1KMT2AMEN1
SCHEMBL23401573 0.88 USP2 (0.38) LMNATSHRDCTPP1KMT2AMEN1
SCHEMBL23402018 0.87 HPGD (0.42) LMNATSHRHIF1AHPGDTP53
SCHEMBL23399641 0.86 RPA1 (0.41) LMNATSHRKMT2AMEN1HPGD
SCHEMBL23398712 0.86 HIF1A (0.39) LMNATSHRDCTPP1KMT2AMEN1
SCHEMBL23398459 0.83 LMNA (0.44) LMNATSHRKMT2AHIF1AKDM4E
SCHEMBL23399835 0.83 ALDH1A1 (0.36) LMNATSHRKMT2AKDM4EHSD17B10
SCHEMBL23398764 0.83 DCTPP1 (0.42) LMNADCTPP1KMT2AMEN1HIF1A
SCHEMBL23401053 0.81 MAPT (0.50) LMNATSHRKMT2AMEN1HIF1A

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
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed