SCHEMBL6703841

SCHEMBL6703841

CCCCCCCCC(Br)C(=O)c1cc(OC)c(Cl)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.46
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
LMNA P02545 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LCK P06239 1/20 0.42
PPARD Q03181 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
TAS1R3 Q7RTX0 2/20 0.40
TAS1R1 Q7RTX1 2/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 2/20 0.39
THRA P10827 1/20 0.39
TRPV1 Q8NER1 2/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38

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
SCHEMBL30859429 0.82 ZDHHC7 (0.48) ZDHHC7ALDH1A1LMNAL3MBTL1LCK
SCHEMBL30859433 0.80 ZDHHC7 (0.46) ZDHHC7NPSR1LCKPPARDZDHHC20
SCHEMBL6702779 0.77 MEN1 (0.52) ALDH1A1TSHRLMNANPSR1L3MBTL1
SCHEMBL6698989 0.76 ACHE (0.46) ALDH1A1TSHRLMNAMAPTHSD17B10
SCHEMBL14707703 0.75 L3MBTL1 (0.46) ZDHHC7ALDH1A1LMNANPSR1L3MBTL1
SCHEMBL6983914 0.72 TRPV1 (0.46) ALDH1A1TSHRLMNANPSR1L3MBTL1
SCHEMBL4775195 0.72 LMNA (0.45) ALDH1A1TSHRLMNANPSR1PPARG
SCHEMBL29767830 0.71 ZDHHC7 (0.44) ZDHHC7NPSR1LCKPPARDZDHHC20
SCHEMBL6743024 0.70 LCK (0.58) ALDH1A1NPSR1L3MBTL1LCKMAPT
SCHEMBL29767822 0.70 ALOX5 (0.46) ZDHHC7LCKPPARDZDHHC20ZDHHC2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040198793-A1 Chemical process and new intermediates SANOFI-SYNTHELABO (FR) 2004-10-07 US disclosed
CN-1478075-A Chemical process and new intermediates ��ŵ�Ѻϳ�ʵ���� 2004-02-25 CN disclosed
EP-1345897-A1 CHEMICAL PROCESS AND NEW INTERMEDIATES SANOFI-SYNTHELABO (FR) 2003-09-24 EP disclosed
WO-2002044150-A1 CHEMICAL PROCESS AND NEW INTERMEDIATES SANOFI-SYNTHELABO (FR) 2002-06-06 WO disclosed