SCHEMBL4401170

SCHEMBL4401170

Cc1cccc(CS(=O)(=O)Cc2cccc(C)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.62
KMT2A Q03164 2/20 0.62
TP53 P04637 2/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
IDO1 P14902 2/20 0.48
MEN1 O00255 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.46
ACHE P22303 1/20 0.46

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
SCHEMBL15944742 0.94 ALDH1A1 (0.61) ALDH1A1KMT2ATP53LMNAPOLB
SCHEMBL10304935 0.92 KMT2A (0.55) ALDH1A1KMT2ATP53LMNAPOLB
SCHEMBL14426934 0.87 ALDH1A1 (0.51) ALDH1A1KMT2ATP53LMNAPOLB
SCHEMBL17571922 0.85 KMT2A (0.54) ALDH1A1KMT2ATP53LMNAPOLB
SCHEMBL3894959 0.85 ALDH1A1 (0.53) ALDH1A1KMT2ATP53POLBTAAR1
SCHEMBL2377394 0.85 ALDH1A1 (0.49) ALDH1A1KMT2APOLBTAAR1IDO1
SCHEMBL3590222 0.83 CA1 (0.57) ALDH1A1KMT2ATAAR1IDO1ACHE
SCHEMBL9421726 0.83 FAAH (0.57) ALDH1A1KMT2APOLBTAAR1IDO1
SCHEMBL2377389 0.83 KMT2A (0.48) ALDH1A1KMT2APOLBTAAR1IDO1
SCHEMBL1714793 0.83 KMT2A (0.48) ALDH1A1KMT2ATP53LMNAPOLB

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
EP-1675930-B1 NEW MATERIALS FOR ELECTROLUMINESCENCE AND THE UTILIZATION THEREOF MERCK PATENT GMBH (DE) 2018-05-30 EP disclosed
US-8173276-B2 Materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2012-05-08 US disclosed
US-20100102305-A1 MATERIALS FOR ELECTROLUMINESCENCE AND THE UTILIZATION THEREOF MERCK PATENT GMBH (DE) 2010-04-29 US disclosed
US-7659540-B2 Materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2010-02-09 US disclosed
US-7659540-B2 Materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2010-02-09 US disclosed
US-20070080343-A1 New materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2007-04-12 US disclosed
US-20070080343-A1 New materials for electroluminescence and the utilization thereof MERCK PATENT GMBH (DE) 2007-04-12 US disclosed
CN-1149191-C Azetidine derivatives, Preparation and medicines containing them ���ĵ�˹ҩ��ɷ����޹�˾ 2004-05-12 CN disclosed
CN-1316991-A Azetidine derivatives, preparation and medicines containing them AVENTIS PHARMA SA (FR) 2001-10-10 CN disclosed
EP-0765339-B1 3-AMINO-2-OXO-1-PIPERIDINEACETIC DERIVATIVES CONTAINING AN ARGININE MIMIC AS ENZYME INHIBITORS CORVAS INT INC (US) 1999-01-27 EP disclosed