SCHEMBL6447472

SCHEMBL6447472

Cc1ccc(-c2ccccc2OC(=O)OC(C)(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 4/20 0.41
HTT P42858 1/20 0.41
ELANE P08246 1/20 0.41
SYK P43405 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
GLA P06280 1/20 0.38
RAB9A P51151 1/20 0.38
PAX8 Q06710 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
FABP3 P05413 2/20 0.38
FABP7 O15540 1/20 0.38
FABP5 Q01469 1/20 0.38
EDNRB P24530 1/20 0.36
EDNRA P25101 1/20 0.36
MAPT P10636 2/20 0.36

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
SCHEMBL9573004 0.89 FABP3 (0.47) LMNAL3MBTL1MAPK1TDP1ALDH1A1
SCHEMBL6448663 0.83 SLC13A5 (0.39) LMNAALDH1A1HTTELANEMTNR1A
SCHEMBL9754835 0.83 KDM4E (0.51) LMNAL3MBTL1MAPK1TDP1ALDH1A1
SCHEMBL6447567 0.79 LMNA (0.55) LMNAL3MBTL1MAPK1TDP1ALDH1A1
SCHEMBL709954 0.79 LMNA (0.51) LMNAL3MBTL1MAPK1TDP1ALDH1A1
SCHEMBL867780 0.79 MAOB (0.52) LMNAL3MBTL1MAPK1TDP1ALDH1A1
SCHEMBL17277985 0.78 TDP1 (0.39) LMNAL3MBTL1MAPK1TDP1ALDH1A1
SCHEMBL7647143 0.78 LMNA (0.50) LMNAL3MBTL1MAPK1TDP1ALDH1A1
SCHEMBL20382703 0.77 ELANE (0.47) LMNAL3MBTL1TDP1ELANEMEN1
SCHEMBL17703424 0.77 LMNA (0.54) LMNAL3MBTL1MAPK1TDP1ALDH1A1

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-1210322-B1 METHOD FOR CARRYING OUT THE SIDE CHAIN BROMINATION OF 4-METHYL BIPHENYL DERIVATIVES SUBSTITUTED AT THE 2'-POSITION BOEHRINGER INGELHEIM PHARMA (DE) 2005-02-09 EP disclosed
WO-1999033788-A2 METHOD FOR PRODUCING AROMATIC BROMOMETHYL BIPHENYL COMPOUNDS GREAT LAKES CHEMICAL KONSTANZ GMBH (DE) 1999-07-08 WO disclosed
WO-1991013063-A1 NEW BENZIMIDAZOLE DERIVATIVES, METHOD FOR PREPARING THEM AND THEIR PHARMACEUTICAL USE SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1991-09-05 WO disclosed