SCHEMBL7022017

SCHEMBL7022017

Cc1ccc(C(=S)CCCN2CCOCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.57
MAPK1 P28482 1/20 0.57
HTT P42858 1/20 0.57
RECQL P46063 1/20 0.55
ALDH1A1 P00352 5/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
GAA P10253 1/20 0.53
POLB P06746 2/20 0.51
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
RAB9A P51151 1/20 0.47
FAAH O00519 1/20 0.46
MGLL Q99685 1/20 0.46
MEN1 O00255 1/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL12123790 0.76 ALDH1A1 (0.73) LMNAHTTALDH1A1SMN1; SMN2GAA
SCHEMBL31093054 0.76 ALDH1A1 (0.52) LMNAMAPK1HTTALDH1A1SMN1; SMN2
SCHEMBL8917488 0.75 KMT2A (0.67) LMNAALDH1A1SMN1; SMN2GAAPOLB
SCHEMBL10876603 0.75 ALDH1A1 (0.42) LMNAHTTALDH1A1SMN1; SMN2GAA
Hydrochloric Acid SCHEMBL7932182 0.75 ALDH1A1 (0.74) LMNAHTTALDH1A1SMN1; SMN2GAA
SCHEMBL5560298 0.73 LMNA (0.48) LMNAMAPK1HTTRECQLALDH1A1
SCHEMBL763452 0.73 HTT (0.78) LMNAMAPK1HTTALDH1A1SMN1; SMN2
SCHEMBL12765222 0.73 SIGMAR1 (0.70) HTTRECQLSMN1; SMN2POLBKMT2A
SCHEMBL23689359 0.72 HPGD (0.55) LMNAMAPK1RECQLALDH1A1SMN1; SMN2
SCHEMBL17888439 0.72 ALDH1A1 (0.69) LMNAMAPK1HTTALDH1A1SMN1; SMN2

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-0983277-B1 POLYBORATE COINITIATORS FOR PHOTOPOLYMERIZATION CIBA SC HOLDING AG (CH) 2003-01-22 EP disclosed
US-6210863-B1 ORTHO-SUBSTITUTED ON AT LEAST TWO ARYL RADICALS, ADDITION POLYMERIZATION CIBA SPECIALTY CHEMICALS CORPORATION 2001-04-03 US disclosed
US-6087062-A COINITIATOR INCLUDING ELECTRON ACCEPTOR COMPOUND; EFFICIENCY, PHOTOSENSITIVITY CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-07-11 US disclosed
US-6057078-A PHOTOGRAPHY CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-05-02 US disclosed
US-6045974-A ADDITION PHOTOPOLYMERIZATION OF NONVOLATILE MONOMERIC, OLIGOMERIC OR POLYMERIC COMPOUNDS CONTAINING AT LEAST ONE ETHYLENICALLY UNSATURATED DOUBLE BOND CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-04-04 US disclosed
EP-0983277-A1 POLYBORATE COINITIATORS FOR PHOTOPOLYMERIZATION Ciba SC Holding AG (CH) 2000-03-08 EP disclosed
US-6011180-A Acid-stable borates for photopolymerization CIBA SPECIALTY CHEMICALS CORPORATION 2000-01-04 US disclosed
US-5952152-A POLYMERIZABLE MIXTURE COMPRISING AT LEAST ONE ETHYLENICALLY UNSATURATED COMPOUND AND AN ANIONIC BORON COMPOUND ACTIVATOR CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-09-14 US disclosed
US-5932393-A Borate photoinitiators from monoboranes CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-03 US disclosed
WO-1998052952-A1 POLYBORATE COINITIATORS FOR PHOTOPOLYMERIZATION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1998-11-26 WO disclosed
US-5807905-A POLYMERIZATION OF UNSATURATED COMPOUNDS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-09-15 US disclosed