SCHEMBL1899113

SCHEMBL1899113

CCCCCCCCc1c(CCCCCCCC)c2cc(/C=C/c3ccc(Br)cc3)ccc2c2ccc(/C=C/c3ccc(Br)cc3)cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.37
LMNA P02545 2/20 0.37
XBP1 P17861 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CYP2C19 P33261 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36
TUBA3E Q6PEY2 1/20 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
SCHEMBL1899115 1.00 ATM (0.37) ATMLMNAXBP1SMN1; SMN2NPSR1
SCHEMBL17878901 0.82 SRC (0.40) LMNACYP2C19KDM4EALDH1A1SRC
SCHEMBL1893401 0.82 SRC (0.40) LMNACYP2C19KDM4EALDH1A1SRC
SCHEMBL19767756 0.80 SRC (0.38) ATMLMNACYP2C19KDM4EALDH1A1
SCHEMBL5414444 0.76 SRC (0.40) ATMLMNACYP2C19KDM4EALDH1A1
SCHEMBL13047005 0.75 SRC (0.35) ATMLMNACYP2C19SRCCHRNA7
SCHEMBL4442150 0.71 RAB9A (0.50) LMNASMN1; SMN2CYP2C19KDM4EALDH1A1
SCHEMBL4442149 0.71 RAB9A (0.50) LMNASMN1; SMN2CYP2C19KDM4EALDH1A1
SCHEMBL13321988 0.71 THRA (0.46) LMNACYP2C19KDM4EALDH1A1CYP1A2
SCHEMBL5058721 0.71 PRKCE (0.46) ATMLMNASMN1; SMN2NPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947382-B2 Electroluminescent polymers and the use thereof MERCK PATENT GMBH (DE) 2011-05-24 US disclosed
US-7947382-B2 Electroluminescent polymers and the use thereof MERCK PATENT GMBH (DE) 2011-05-24 US disclosed
US-7947382-B2 Electroluminescent polymers and the use thereof MERCK PATENT GMBH (DE) 2011-05-24 US disclosed
EP-1741149-B1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GMBH (DE) 2008-12-24 EP disclosed
EP-1741149-B1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GMBH (DE) 2008-12-24 EP disclosed
US-20070205714-A1 Electroluminescent Polymers and the Use Thereof MERCK PATENT GMBH (DE) 2007-09-06 US disclosed
US-20070205714-A1 Electroluminescent Polymers and the Use Thereof MERCK PATENT GMBH (DE) 2007-09-06 US disclosed
US-20070205714-A1 Electroluminescent Polymers and the Use Thereof MERCK PATENT GMBH (DE) 2007-09-06 US disclosed
EP-1741149-A1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GmbH (DE) 2007-01-10 EP disclosed
WO-2005104264-A1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GMBH (DE) 2005-11-03 WO disclosed