SCHEMBL11036136

SCHEMBL11036136

CCOc1ccc(C)cc1N1NC(OC)OC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 6/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 4/20 0.37
HTT P42858 2/20 0.37
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
MAPK1 P28482 2/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
HPGD P15428 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CYP1A2 P05177 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
SCHEMBL11038829 0.90 TSHR (0.36) KDM4ENPC1RAB9ATSHRMEN1
SCHEMBL11558647 0.83 ALDH1A1 (0.41) MEN1KMT2ALMNAHTTHSD17B10
SCHEMBL10826621 0.79 ACHE (0.39) KDM4ETSHRKMT2APOLBLMNA
SCHEMBL2235108 0.72 ALDH1A1 (0.38) KDM4ERAB9AKMT2AL3MBTL1ALDH1A1
SCHEMBL9814732 0.67 KDM4E (0.48) KDM4ENPC1RAB9ATSHRMEN1
SCHEMBL11620524 0.66 GSK3A (0.38)
SCHEMBL11036133 0.65 KDM4E (0.49) KDM4ENPC1RAB9ATSHRMEN1
SCHEMBL11620916 0.64 RAD51 (0.36) MEN1KMT2AMAPK1NPSR1
SCHEMBL11556229 0.64 ELANE (0.38) KDM4EMEN1KMT2ALMNAHTT
SCHEMBL25575759 0.64 CRBN (0.49) KDM4ENPC1RAB9ATSHRMEN1

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-0143440-A2 Insecticidal composition MITSUBISHI KASEI CORPORATION (JP) 1985-06-05 EP claimed
EP-0143440-A2 Insecticidal composition MITSUBISHI KASEI CORPORATION (JP) 1985-06-05 EP disclosed