SCHEMBL4449148

SCHEMBL4449148

Cc1ccc(OC#N)c(Cc2cc(C)ccc2OC#N)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.39
ACHE P22303 1/20 0.38
ALDH1A1 P00352 4/20 0.35
MAPT P10636 3/20 0.35
POLB P06746 2/20 0.35
CYP3A4 P08684 1/20 0.34
SLC6A4 P31645 3/20 0.34
HTR2A P28223 1/20 0.34
KCNH2 Q12809 1/20 0.34
AR P10275 6/20 0.33
GPR55 Q9Y2T6 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
SLC6A2 P23975 1/20 0.33
THRB P10828 1/20 0.33
L3MBTL4 Q8NA19 1/20 0.33
L3MBTL3 Q96JM7 1/20 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
SCHEMBL8961905 0.87 AMY1A (0.35) AMY1AACHEALDH1A1MAPTPOLB
SCHEMBL27516451 0.87 L3MBTL1 (0.40) ACHEALDH1A1MAPTPOLBCYP3A4
SCHEMBL16742413 0.80 L3MBTL1 (0.51) ALDH1A1MAPTPOLBSLC6A4AR
SCHEMBL10887583 0.78 HTR2A (0.31) SLC6A4HTR2AKCNH2TAAR1
SCHEMBL28108652 0.78 ACHE (0.35) AMY1AACHESLC6A4HTR2AKCNH2
SCHEMBL29489134 0.78 GAA (0.44) ACHEALDH1A1MAPTCYP3A4AR
SCHEMBL8985167 0.78 GAA (0.44) ACHEALDH1A1MAPTCYP3A4AR
SCHEMBL8961877 0.77 ATM (0.39) ALDH1A1MAPTCYP3A4SLC6A4HTR2A
SCHEMBL11288361 0.75 ACHE (0.60) AMY1AACHEALDH1A1MAPTPOLB
SCHEMBL9419412 0.74 CYP1A2 (0.45) ACHEALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5488144-A Bifunctional aromatic cyanates, prepolymers and electrical laminates made therefrom KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-30 US claimed
US-8962138-B2 Organically functionalized polysiloxane nanoparticles, method for the production thereof, and use thereof FRAUNHOFER-GESELLSCHAFT ZUR FOERDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2015-02-24 US disclosed
US-8242035-B2 Flame-resistant, low-temperature curing cyanate-based prepreg resins for honeycomb sandwich components with excellent surfaces Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2012-08-14 US disclosed
US-20120135217-A1 Hybrid Polymers from Cyanates and Silazanes, Process for Their Production and Use CLARIANT INTERNATIONAL, LTD. (CH) 2012-05-31 US disclosed
US-20090054540-A1 Cyanate-Based, Carbon-Dioxide-Filled Structured Foams and Method for Their Production FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2009-02-26 US disclosed
US-20080119630-A1 Flame-Resistant, Low-Temperature Curing Cyanate-Based Resins with Improved Properties FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2008-05-22 US disclosed
US-20080032089-A1 Flame-Resistant, Low-Temperature Curing Cyanate-Based Prepreg Resins for Honeycomb Sandwich Components with Excellent Surfaces FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2008-02-07 US 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-5488144-A Bifunctional aromatic cyanates, prepolymers and electrical laminates made therefrom KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-30 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