SCHEMBL11090671

SCHEMBL11090671

ClCCCCCOc1ccccc1OCCCCCCl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
L3MBTL1 Q9Y468 6/20 0.48
TDP1 Q9NUW8 2/20 0.48
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48
PTK2B Q14289 1/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 3/20 0.48
JAK2 O60674 1/20 0.48
GAA P10253 1/20 0.48
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 1/20 0.44
KCNA3 P22001 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2D6 P10635 1/20 0.42
MEN1 O00255 1/20 0.42
NR1I2 O75469 1/20 0.42

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
SCHEMBL11091669 0.97 KDM4E (0.52) KDM4EL3MBTL1TDP1NPC1POLB
SCHEMBL11097405 0.90 KDM4E (0.54) KDM4EL3MBTL1TDP1NPC1POLB
SCHEMBL9547466 0.89 L3MBTL1 (0.65) L3MBTL1TDP1NPC1MAPTLMNA
SCHEMBL28809812 0.87 L3MBTL1 (0.52) KDM4EL3MBTL1TDP1NPC1POLB
SCHEMBL5659890 0.87 L3MBTL1 (0.67) L3MBTL1TDP1NPC1MAPTLMNA
SCHEMBL3472110 0.85 NPC1 (0.42) KDM4EL3MBTL1TDP1NPC1POLB
SCHEMBL20530589 0.85 ALDH1A1 (0.58) KDM4EL3MBTL1TDP1NPC1MAPT
SCHEMBL20530525 0.85 ALDH1A1 (0.58) KDM4EL3MBTL1TDP1NPC1MAPT
SCHEMBL9150153 0.85 GAA (0.67) L3MBTL1NPC1POLBPTK2BMAPT
SCHEMBL6848695 0.84 KDM4E (0.54) KDM4EL3MBTL1TDP1NPC1MAPT

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-0032063-B1 NOVEL SUBSTITUTED ARYLENE COMPOUNDS AND PROCESSES FOR THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1984-03-14 EP disclosed
US-4351950-A Anti-arteriosclerotic agents WARNER-LAMBERT COMPANY (US) 1982-09-28 US disclosed
EP-0032063-A2 Novel substituted arylene compounds and processes for their production WARNER-LAMBERT COMPANY (US) 1981-07-15 EP disclosed