SCHEMBL10378609

SCHEMBL10378609

CCOCCOCc1ccc(OCCNc2ncnc(C)c2Cl)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.37
KDM4E B2RXH2 4/20 0.36
HTT P42858 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MAPK1 P28482 2/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
EGFR P00533 2/20 0.33
ERBB2 P04626 2/20 0.33
CHRM4 P08173 2/20 0.33
MAPT P10636 2/20 0.32
POLB P06746 1/20 0.32
RECQL P46063 1/20 0.32
THRB P10828 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
BRD4 O60885 1/20 0.32
ERBB4 Q15303 1/20 0.32

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
SCHEMBL9774853 0.91 TP53 (0.37) TP53KDM4EHTTSMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL10376554 0.90 NPC1 (0.37) TP53KDM4EHTTSMN1; SMN2MAPK1
SCHEMBL11107034 0.87 PDE5A (0.38) KDM4EHTTSMN1; SMN2MAPK1LMNA
SCHEMBL11108006 0.85 MAPT (0.39) KDM4EHTTSMN1; SMN2MAPK1LMNA
SCHEMBL11103934 0.83 SMN1; SMN2 (0.39) KDM4EHTTSMN1; SMN2MAPK1LMNA
SCHEMBL10376504 0.83 SMN1; SMN2 (0.38) KDM4EHTTSMN1; SMN2MAPK1LMNA
SCHEMBL11107563 0.82 S1PR2 (0.40) HTTSMN1; SMN2MAPK1TSHRHSD17B10
SCHEMBL10377982 0.82 MAPT (0.39) KDM4EHTTSMN1; SMN2MAPK1LMNA
SCHEMBL11290131 0.82 KDM4E (0.34) KDM4EHTTSMN1; SMN2MAPK1LMNA
SCHEMBL11287336 0.82 CHRM4 (0.35) TP53KDM4EHTTSMN1; SMN2MAPK1

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-0196524-B1 PHENOXYALKYLAMINOPYRIMIDINE DERIVATIVES, THEIR PREPARATION AND INSECTICIDAL AND ACARICIDAL COMPOSITIONS CONTAINING THEM SANKYO COMPANY LIMITED (JP) 1990-03-07 EP disclosed
US-4845097-A AGRICULTURE SANKYO COMPANY LIMITED (JP) 1989-07-04 US disclosed
EP-0196524-A2 Phenoxyalkylaminopyrimidine derivatives, their preparation and insecticidal and acaricidal compositions containing them SANKYO COMPANY LIMITED (JP) 1986-10-08 EP disclosed