SCHEMBL7767196

SCHEMBL7767196

Fc1cc(Br)cc(F)c1OCC(F)F

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.47
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
SCN9A Q15858 2/20 0.32
SCN5A Q14524 1/20 0.32

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
SCHEMBL7761314 0.79 TAAR1 (0.42) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL7766037 0.75 AAK1 (0.46) MAPTMAPK1HTT
SCHEMBL3800127 0.74 MAPT (0.45) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL8453893 0.74 SCN9A (0.44) LMNATSHRSCN9ASCN5A
SCHEMBL31168037 0.74 SOD1 (0.39)
SCHEMBL7769819 0.73 MAPT (0.42) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL4550768 0.73 SCN5A (0.34) MAPTKMT2ANPSR1LMNATSHR
SCHEMBL28389420 0.72
SCHEMBL7765182 0.72 MAPT (0.41) MAPTKMT2AMAPK1HTTNPSR1
Hydrochloric Acid SCHEMBL2716655 0.72 MAPT (0.35) MAPTKMT2AMAPK1HTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727428-B1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHINETSU CHEMICAL CO (JP) 2001-06-06 EP disclosed
US-6159393-A Benzene derivatives and liquid-crystalline medium MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-12-12 US disclosed
EP-0775101-B1 BENZENE DERIVATIVES AND LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2000-05-03 EP disclosed
US-5665271-A Silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-09-09 US disclosed
EP-0775101-A1 BENZENE DERIVATIVES AND LIQUID CRYSTAL MEDIUM MERCK PATENT GmbH (DE) 1997-05-28 EP disclosed
EP-0727428-A1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-08-21 EP disclosed
WO-1996005159-A1 BENZENE DERIVATIVES AND LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 1996-02-22 WO disclosed
US-5422035-A Mixture of polar compounds free of nitrile-containing compounds havng a positive dielectric anisotropy; twisted and supertwisted nematic cells; high resistance; low voltage MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-06-06 US disclosed