SCHEMBL10378038

SCHEMBL10378038

CCON=CCc1ccc(OCCNc2ncnc(C)c2Cl)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM4 P08173 2/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MAPK1 P28482 2/20 0.30
▸ HTT P42858 2/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ EGFR P00533 1/20 0.30
▸ ERBB2 P04626 1/20 0.30
▸ ERBB4 Q15303 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ PIK3CD O00329 1/20 0.30
▸ PIK3R1 P27986 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ STAT3 P40763 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL10378037 1.00 CHRM4 (0.32) CHRM4SMN1; SMN2TP53MAPK1HTT
SCHEMBL10378454 0.87 CHRM4 (0.33) CHRM4SMN1; SMN2TP53MAPK1BRD4
SCHEMBL10378455 0.87 CHRM4 (0.33) CHRM4SMN1; SMN2TP53MAPK1BRD4
SCHEMBL11101848 0.86 MAPT (0.39) CHRM4SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL10378009 0.85 S1PR2 (0.35) CHRM4SMN1; SMN2TP53MAPK1BRD4
SCHEMBL11107034 0.83 PDE5A (0.38) CHRM4SMN1; SMN2MAPK1HTTBRD4
SCHEMBL11108006 0.81 MAPT (0.39) CHRM4SMN1; SMN2MAPK1HTTKDM4E
SCHEMBL9774853 0.81 TP53 (0.37) CHRM4SMN1; SMN2TP53MAPK1HTT
SCHEMBL10378609 0.80 TP53 (0.37) CHRM4SMN1; SMN2TP53MAPK1HTT
Hydrochloric Acid SCHEMBL10376554 0.80 NPC1 (0.37) CHRM4SMN1; SMN2TP53MAPK1HTT

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
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