SCHEMBL6404791

SCHEMBL6404791

CCCc1ccc(C(=S)S)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 2/20 0.50
THRB P10828 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
LPL P06858 1/20 0.47
LIPG Q9Y5X9 1/20 0.47
POLB P06746 3/20 0.44
CTDSP1 Q9GZU7 3/20 0.44
ALDH1A1 P00352 3/20 0.44
GAA P10253 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
CA2 P00918 1/20 0.39

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
SCHEMBL11534948 0.84 ESR1 (0.58) THRBLPLLIPGALDH1A1KDM4E
SCHEMBL9338315 0.80 PLK1 (0.52) PLK1THRBL3MBTL1LPLLIPG
SCHEMBL7897931 0.78 SMN1; SMN2 (0.69) PLK1THRBL3MBTL1LPLLIPG
SCHEMBL5068458 0.78 PLK1 (0.50) PLK1THRBL3MBTL1LPLLIPG
Hydrochloric Acid SCHEMBL7895919 0.78 L3MBTL1 (0.52) PLK1THRBL3MBTL1LPLLIPG
SCHEMBL10871765 0.78 PLK1 (0.55) PLK1THRBL3MBTL1LPLLIPG
SCHEMBL2773466 0.75 CA1 (0.36) SMN1; SMN2CA2
SCHEMBL142480 0.75 LPL (0.62) PLK1THRBL3MBTL1LPLLIPG
SCHEMBL14218108 0.75 RARB (0.49) PLK1THRBL3MBTL1LPLLIPG
SCHEMBL10874305 0.75 L3MBTL1 (0.49) PLK1THRBL3MBTL1LPLLIPG

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-1245660-B1 Liquid crystal compounds having bis(trifluoromethyl)phenyl rings, liquid crystal compositions and liquid crystal display devices CHISSO CORP (JP) 2005-02-23 EP disclosed
US-6844032-B2 Liquid crystal compounds having bis(trifluoromethyl) phenyl rings, liquid crystal compositions and liquid crystal display devices CHISSO CORPORATION (JP) 2005-01-18 US disclosed
EP-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed
US-20030077405-A1 Liquid crystal compounds having bis(trifluoromethyl) phenyl rings, liquid crystal compositions and liquid crystal display devices JNC PETROCHEMICAL CORPORATION (JP) 2003-04-24 US disclosed
EP-1245660-A2 Liquid crystal compounds having bis(trifluoromethyl)phenyl rings, liquid crystal compositions and liquid crystal display devices CHISSO CORPORATION (JP) 2002-10-02 EP disclosed
EP-0920405-B1 FLUOROVINYL DERIVATIVE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORP (JP) 2001-07-11 EP disclosed
US-6207076-B1 HIGH ELASTIC CONSTANT RATIO, LOW VISCOSITY, WIDE NEMATIC PHASE TEMPERATURE RANGE, CHEMICAL STABILITY CHISSO CORPORATION (JP) 2001-03-27 US disclosed
US-6177154-B1 MISCIBILITY; LOW IN THRESHOLD VOLTAGE, INDUCE LARGE PRETILT ANGLE, HIGH IN VOLTAGE HOLDING RATIO AND ARE LOW IN ITS DEPENDENCY ON TEMPERATURE CHISSO CORPORATION (JP) 2001-01-23 US disclosed
EP-0920405-A1 FLUOROVINYL DERIVATIVE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 1999-06-09 EP disclosed
EP-0893423-A1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORPORATION (JP) 1999-01-27 EP disclosed
WO-1998008791-A1 FLUOROVINYL DERIVATIVE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 1998-03-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030077405-A1 Liquid crystal compounds having bis(trifluoromethyl) phenyl rings, liquid crystal compositions and liquid crystal display devices RCC1, KCNH2, OCIAD2 PLK1 1064/4885THRB 3387/4885L3MBTL1 1069/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.