SCHEMBL7557322

SCHEMBL7557322

FC1(F)Cc2ccccc2-c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.39
LMNA P02545 4/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 1/20 0.33
ALOX12 P18054 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33
THRB P10828 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KMT2A Q03164 3/20 0.33

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
SCHEMBL30638044 0.81 HTR2A (0.35)
SCHEMBL4459204 0.74 NPSR1 (0.50) LMNAALDH1A1NPSR1HTTL3MBTL1
SCHEMBL4338809 0.74 LMNA (0.34) LMNAALDH1A1SMN1; SMN2HPGDNPSR1
SCHEMBL25201447 0.74 CFTR (0.38) PDK2LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL19820933 0.74 HTR2A (0.44)
SCHEMBL28807849 0.74 ALDH1A1 (0.37) PDK2LMNAALDH1A1KDM4EMAPT
SCHEMBL3791030 0.74 LMNA (0.39) PDK2LMNAALDH1A1KDM4EMAPT
SCHEMBL14922392 0.71 PDK2 (0.41) PDK2LMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL18678350 0.71 HTR2A (0.41) LMNAALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL30757484 0.70 ESR1 (0.40) PDK2LMNAALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946477-B1 DERIVATIVES OF 9,9-DIFLUORO-9,10-DIHYDROPHENANTHRENE FOR LIQUID CRYSTAL MIXTURES AVENTIS RES & TECHNOLOGY GMBH (DE) 2002-07-31 EP claimed
EP-0946477-B1 DERIVATIVES OF 9,9-DIFLUORO-9,10-DIHYDROPHENANTHRENE FOR LIQUID CRYSTAL MIXTURES AVENTIS RES & TECHNOLOGY GMBH (DE) 2002-07-31 EP disclosed
EP-0946473-B1 FLUORINATED PHENANTRENE DERIVATIVES FOR LIQUID CRYSTAL MIXTURES AVENTIS RES & TECHNOLOGY GMBH (DE) 2002-07-31 EP disclosed
EP-0946477-B1 DERIVATIVES OF 9,9-DIFLUORO-9,10-DIHYDROPHENANTHRENE FOR LIQUID CRYSTAL MIXTURES AVENTIS RES & TECHNOLOGY GMBH (DE) 2002-07-31 EP disclosed
US-6168838-B1 FOR FERROELECTRIC SWITCHING AND/OR DISPLAY DEVICE AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 2001-01-02 US disclosed
EP-0946477-A1 DERIVATIVES OF 9,9-DIFLUORO-9,10-DIHYDROPHENANTHRENE FOR LIQUID CRYSTAL MIXTURES Aventis Research & Technologies GmbH & Co. KG. (DE) 1999-10-06 EP disclosed
EP-0946477-A1 DERIVATIVES OF 9,9-DIFLUORO-9,10-DIHYDROPHENANTHRENE FOR LIQUID CRYSTAL MIXTURES Aventis Research & Technologies GmbH & Co. KG. (DE) 1999-10-06 EP disclosed
EP-0946473-A1 FLUORINATED PHENANTRENE DERIVATIVES FOR LIQUID CRYSTAL MIXTURES Aventis Research & Technologies GmbH & Co. KG. (DE) 1999-10-06 EP disclosed
WO-1998027035-A1 FLUORINATED PHENANTRENE DERIVATIVES FOR LIQUID CRYSTAL MIXTURES AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO KG (DE) 1998-06-25 WO disclosed
WO-1998027043-A1 DERIVATIVES OF 9,9-DIFLUORO-9,10-DIHYDROPHENANTHRENE FOR LIQUID CRYSTAL MIXTURES AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 1998-06-25 WO disclosed
WO-1998027043-A1 DERIVATIVES OF 9,9-DIFLUORO-9,10-DIHYDROPHENANTHRENE FOR LIQUID CRYSTAL MIXTURES AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 1998-06-25 WO disclosed