SCHEMBL6845965

SCHEMBL6845965

CCC1CN1S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
MCOLN3 Q8TDD5 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
PSEN1 P49768 1/20 0.49
PSEN2 P49810 1/20 0.49
APH1B Q8WW43 1/20 0.49
NCSTN Q92542 1/20 0.49
APH1A Q96BI3 1/20 0.49
PSENEN Q9NZ42 1/20 0.49
POLB P06746 2/20 0.48
PKM P14618 2/20 0.47
TSHR P16473 2/20 0.47
TP53 P04637 1/20 0.47
ACHE P22303 1/20 0.46
MMP2 P08253 1/20 0.46
HTT P42858 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
SCHEMBL12574213 1.00 ALDH1A1 (0.50) ALDH1A1LMNAKMT2AMCOLN3L3MBTL1
SCHEMBL6845966 1.00 ALDH1A1 (0.50) ALDH1A1LMNAKMT2AMCOLN3L3MBTL1
SCHEMBL11973131 0.88 MCOLN3 (0.49) ALDH1A1LMNAKMT2AMCOLN3L3MBTL1
SCHEMBL11991815 0.87 PSEN1 (0.51) ALDH1A1LMNAKMT2AMCOLN3L3MBTL1
SCHEMBL28453183 0.85 PSEN1 (0.48) ALDH1A1L3MBTL1PSEN1PSEN2APH1B
SCHEMBL8474798 0.85 POLB (0.50) ALDH1A1LMNAKMT2AMCOLN3L3MBTL1
SCHEMBL30874328 0.85 KMT2A (0.53) ALDH1A1LMNAKMT2AMCOLN3L3MBTL1
SCHEMBL6642041 0.84 L3MBTL1 (0.61) ALDH1A1KMT2AL3MBTL1NPSR1PSEN1
SCHEMBL6642037 0.84 L3MBTL1 (0.61) ALDH1A1KMT2AL3MBTL1NPSR1PSEN1
SCHEMBL2600496 0.84 ALDH1A1 (0.46) ALDH1A1LMNAKMT2AMCOLN3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111675806-B Air atmosphere anion ring-opening polymerization method of N-sulfonyl aziridine derivative 上海交通大学 2022-01-11 CN claimed
CN-111675806-A Air atmosphere anion ring-opening polymerization method of N-sulfonyl aziridine derivative 上海交通大学 2020-09-18 CN claimed
EP-0942900-A4 STEREOSPECIFIC PREPARATION OF CHIRAL 1-ARYL- AND 1-HETEROARYL-2-SUBSTITUTED ETHYL-2-AMINES AVENTIS PHARM PROD INC (US) 2004-08-04 EP claimed
US-6433172-B1 CARDIOVASCULAR DISORDERS; HYPOTENSIVE AGENTS; ANTICHOLESTEROL AGENTS AVENTIS PHARMACEUTICALS INC. 2002-08-13 US claimed
EP-0942900-A1 STEREOSPECIFIC PREPARATION OF CHIRAL 1-ARYL- AND 1-HETEROARYL-2-SUBSTITUTED ETHYL-2-AMINES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-09-22 EP claimed
WO-1998011064-A1 STEREOSPECIFIC PREPARATION OF CHIRAL 1-ARYL- AND 1-HETEROARYL-2-SUBSTITUTED ETHYL-2-AMINES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-03-19 WO claimed
CN-111675806-B Air atmosphere anion ring-opening polymerization method of N-sulfonyl aziridine derivative 上海交通大学 2022-01-11 CN disclosed
CN-111675806-A Air atmosphere anion ring-opening polymerization method of N-sulfonyl aziridine derivative 上海交通大学 2020-09-18 CN disclosed
CN-108997215-A A kind of preparation method of 1,2,3,4- tetrahydro isoquinoline derivative 武汉大学 2018-12-14 CN disclosed
EP-0942900-A4 STEREOSPECIFIC PREPARATION OF CHIRAL 1-ARYL- AND 1-HETEROARYL-2-SUBSTITUTED ETHYL-2-AMINES AVENTIS PHARM PROD INC (US) 2004-08-04 EP disclosed
US-6433172-B1 CARDIOVASCULAR DISORDERS; HYPOTENSIVE AGENTS; ANTICHOLESTEROL AGENTS AVENTIS PHARMACEUTICALS INC. 2002-08-13 US disclosed
US-6127550-A Stereospecific preparation of chiral 1-aryl-and 1-heteroaryl-2-substituted ethyl-2-amines RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 2000-10-03 US disclosed
EP-0942900-A1 STEREOSPECIFIC PREPARATION OF CHIRAL 1-ARYL- AND 1-HETEROARYL-2-SUBSTITUTED ETHYL-2-AMINES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-09-22 EP disclosed
WO-1998011064-A1 STEREOSPECIFIC PREPARATION OF CHIRAL 1-ARYL- AND 1-HETEROARYL-2-SUBSTITUTED ETHYL-2-AMINES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-03-19 WO disclosed