SCHEMBL8961822

SCHEMBL8961822

Cc1cc(C)c(OC#N)c(Cc2cc(C)cc(C)c2OC#N)c1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.36
AMY1A P0DUB6 1/20 0.32
HSPA5 P11021 1/20 0.32
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP2D6 P10635 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL8961905 0.87 AMY1A (0.35) ARAMY1AGAATSHR
SCHEMBL10629452 0.85 AR (0.34) ARHSD17B10
SCHEMBL9287974 0.83 AR (0.38) ARGAA
SCHEMBL30002851 0.80 ACHE (0.48) ARGAATSHR
SCHEMBL20866062 0.80 ACHE (0.48) ARGAATSHR
SCHEMBL7918964 0.79 HSPA5 (0.50) ARHSPA5CYP2C9CYP2C19HIF1A
SCHEMBL175692 0.74 SHBG (0.35)
SCHEMBL19102872 0.73 DHFR (0.34) CYP2C9CYP2C19HIF1ACYP2D6HSD17B10
SCHEMBL17771265 0.73 PYCR1 (0.36)
SCHEMBL19865849 0.70 ALDH1A1 (0.35) CYP2C9CYP2C19HIF1ACYP2D6HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116287731-B Method for selectively separating thallium from thallium-containing waste 中南大学 2024-11-29 CN claimed
CN-116287729-B Thallium separation method based on sodium carbonate 中南大学 2024-10-11 CN claimed
CN-116287729-A Thallium separation method based on sodium carbonate 中南大学 2023-06-23 CN claimed
CN-116287731-A Method for selectively separating thallium from thallium-containing waste 中南大学 2023-06-23 CN claimed
US-5488144-A Bifunctional aromatic cyanates, prepolymers and electrical laminates made therefrom KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-30 US claimed
CN-116287731-B Method for selectively separating thallium from thallium-containing waste 中南大学 2024-11-29 CN disclosed
CN-116287729-B Thallium separation method based on sodium carbonate 中南大学 2024-10-11 CN disclosed
CN-116287729-A Thallium separation method based on sodium carbonate 中南大学 2023-06-23 CN disclosed
CN-116287731-A Method for selectively separating thallium from thallium-containing waste 中南大学 2023-06-23 CN disclosed
US-5550282-A CURABLE COMPOSITION COMPRISING PARTIALLY TRIMERIZED PREPOLYMER OF AROMATIC DICYANATE ESTER KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-08-27 US disclosed
US-5539758-A Upconversion pumped thulium fiber amplifier and laser operating at 790 to 830 nm THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1996-07-23 US disclosed
EP-0589198-B1 Rare earth-doped, stabilized cadmium halide glasses CORNING INC (US) 1996-02-07 EP disclosed
US-5488144-A Bifunctional aromatic cyanates, prepolymers and electrical laminates made therefrom KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-30 US disclosed
US-5346865-A Infrared radiation transmission CORNING INCORPORATED (US) 1994-09-13 US disclosed
EP-0589198-A1 Rare earth-doped, stabilized cadmium halide glasses Corning Incorporated (US) 1994-03-30 EP disclosed
US-5240885-A Radiation transparent glass having excellent transmission far into the infrared region of the electromagnetic radiation spectrum CORNING INCORPORATED (US) 1993-08-31 US disclosed
EP-0548970-A2 Prepolymers from bifunctional aromatic cyanates and electrical laminates made therefrom KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1993-06-30 EP disclosed