SCHEMBL859511

SCHEMBL859511

C=CC(S)NCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
SIGMAR1 Q99720 1/20 0.46
TSHR P16473 1/20 0.45
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH7 P40394 1/20 0.41
IDO1 P14902 2/20 0.40
THRB P10828 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ACP3 P15309 3/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
DPP7 Q9UHL4 1/20 0.37

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
SCHEMBL28163082 0.78 SMN1; SMN2 (0.53) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL19985055 0.76 SMN1; SMN2 (0.51) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL27676229 0.76 SMN1; SMN2 (0.51) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL2450662 0.76 SMN1; SMN2 (0.51) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL21193056 0.76 SIGMAR1 (0.55) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL7789516 0.74 SIGMAR1 (0.53) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL28849149 0.74 SMN1; SMN2 (0.50) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL4843164 0.74 SMN1; SMN2 (0.59) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL3293876 0.74 SMN1; SMN2 (0.59) SMN1; SMN2SIGMAR1TSHRATML3MBTL1
SCHEMBL7286679 0.72 SIGMAR1 (0.61) SMN1; SMN2SIGMAR1IDO1THRBMEN1

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-8932976-B2 Preparation of catalyst for bisphenols production DOW GLOBAL TECHNOLOGIES LLC (US) 2015-01-13 US disclosed
CN-101790505-B Method for reducing methanol in recycle streams in bisphenol A production processes DOW WOLFF CELLULOSICS GMBH 2013-12-11 CN disclosed
US-8143456-B2 Method of reducing methanol in recycle streams in bisphenol-A production process DOW GLOBAL TECHNOLOGIES LLC (US) 2012-03-27 US disclosed
US-20110137087-A1 METHOD OF REDUCING METHANOL IN RECYCLE STREAMS IN BISPHENOL-A PRODUCTION PROCESS BLUE CUBE IP LLC 2011-06-09 US disclosed
EP-2158040-B1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES INC (US) 2011-02-16 EP disclosed
CN-101790505-A Method for reducing methanol in recycle streams in bisphenol A production processes DOW GLOBAL TECHNOLOGIES INC 2010-07-28 CN disclosed
US-20100152028-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES LLC 2010-06-17 US disclosed
CN-101678354-A The Preparation of catalysts that is used for bisphenol production DOW GLOBAL TECHNOLOGIES INC 2010-03-24 CN disclosed
EP-2158040-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION Dow Global Technologies Inc. (US) 2010-03-03 EP disclosed
WO-2008157025-A1 PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION DOW GLOBAL TECHNOLOGIES INC. (US) 2008-12-24 WO disclosed