SCHEMBL23723738

SCHEMBL23723738

Clc1nccc(OCc2ccccc2)c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.49
LTA4H P09960 1/20 0.49
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.45
GRM2 Q14416 1/20 0.45
ABCB1 P08183 1/20 0.44
HTR1A P08908 1/20 0.43
DRD2 P14416 1/20 0.43
MPO P05164 1/20 0.42
LIPE Q05469 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM3 P20309 1/20 0.42
CLCN2 P51788 1/20 0.42
PLAU P00749 2/20 0.41
PRMT5 O14744 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 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
SCHEMBL30013758 1.00 MAPK14 (0.49) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL31517959 0.83 L3MBTL1 (0.51) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL8320729 0.83 MAPK14 (0.46) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL10819320 0.83 L3MBTL1 (0.61) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL16094113 0.83 MAPK14 (0.49) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL30666961 0.80 MAPT (0.56) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL30666902 0.80 POLB (0.44) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL23723810 0.80 ACACB (0.46) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL17224562 0.80 MAPT (0.56) MAPK14LTA4HMAPTMAPK1TDP1
SCHEMBL30014456 0.80 ACACB (0.46) MAPK14LTA4HMAPTMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4100124-A1 HETEROCYCLIC COMPOUNDS AS DIHYDROOROTATE DEHYDROGENASE INHIBITORS Janssen Biotech, Inc. (US) 2022-12-14 EP disclosed
CN-115427109-A Heterocyclic compounds as dihydroorotate dehydrogenase inhibitors 詹森生物科技公司 2022-12-02 CN disclosed
WO-2021156787-A1 HETEROCYCLIC COMPOUNDS AS DIHYDROOROTATE DEHYDROGENASE INHIBITORS JANSSEN BIOTECH, INC. (US) 2021-08-12 WO disclosed