SCHEMBL12875640

SCHEMBL12875640

CCc1ccc(N2CCCCC2)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 2/20 0.50
L3MBTL1 Q9Y468 3/20 0.48
TP53BP1 Q12888 1/20 0.48
L3MBTL3 Q96JM7 1/20 0.48
MAPT P10636 4/20 0.48
ALDH1A1 P00352 3/20 0.48
GFER P55789 1/20 0.48
THRB P10828 1/20 0.46
HTT P42858 3/20 0.46
MAPK1 P28482 2/20 0.46
EPHX2 P34913 2/20 0.44
NR1H4 Q96RI1 2/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
RAB9A P51151 1/20 0.44
ALOX15 P16050 2/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL21736792 0.98 L3MBTL1 (0.49) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL20884918 0.85 KDM4E (0.51) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL12845388 0.83 GRM2 (0.48) MEN1KMT2ALMNAL3MBTL1MAPT
SCHEMBL7916691 0.83 DRD4 (0.53) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL5018022 0.83 L3MBTL1 (0.48) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL21736865 0.81 HPGD (0.55) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL1599621 0.79 HTT (0.46) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL21736852 0.79 PRMT6 (0.41) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL7913817 0.79 L3MBTL1 (0.45) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1
SCHEMBL21736813 0.79 HPGD (0.53) MEN1KMT2ASMN1; SMN2LMNAL3MBTL1

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
EP-3611165-A1 PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT Mitsui Chemicals Agro, Inc. (JP) 2020-02-19 EP disclosed
WO-2011021645-A1 BICYCLIC UREA DERIVATIVE OR PHARMACOLOGICALLY PERMITTED SALT THEREOF 大日本住友製薬株式会社 (JP) 2011-02-24 WO disclosed