SCHEMBL7765182

SCHEMBL7765182

FCCOc1c(F)cc(Br)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
KMT2A Q03164 4/20 0.38
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HTR2A P28223 3/20 0.33
HTR2C P28335 3/20 0.33
HTR2B P41595 3/20 0.33
PARP1 P09874 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
PARP3 Q9Y6F1 1/20 0.32
CCNB2 O95067 1/20 0.32
CCNE2 O96020 1/20 0.32
CDK1 P06493 1/20 0.32
CDK4 P11802 1/20 0.32
CCNB1 P14635 1/20 0.32
CCND1 P24385 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
SCHEMBL1776544 0.81 MAPT (0.40) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL13062423 0.79 CCNB2 (0.46) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL7767153 0.78 MAPT (0.41) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL14261934 0.76 THRA (0.48) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL6683559 0.76 THRA (0.48) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL3800127 0.76 MAPT (0.45) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL17467939 0.75 FFAR4 (0.33) MAPTHTR2AHTR2CHTR2BFFAR4
SCHEMBL20658223 0.75 MAPT (0.46) MAPTKMT2AMAPK1HTTNPSR1
SCHEMBL20361246 0.75 TAAR1 (0.44) MAPTLMNAALOX15TSHRFFAR4
SCHEMBL15299318 0.75 MAPT (0.49) 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 3 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-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-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