SCHEMBL3724149

SCHEMBL3724149

CCCC(C)C(C)(C)C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
PRSS1 P07477 4/20 0.36
CTSG P08311 4/20 0.36
CTRB1 P17538 4/20 0.36
CMA1 P23946 4/20 0.36
HDAC7 Q8WUI4 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
DGAT1 O75907 1/20 0.34
TAS1R3 Q7RTX0 3/20 0.34
TAS1R1 Q7RTX1 3/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
CHRM1 P11229 1/20 0.33
AKR1A1 P14550 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR2A P28223 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
SCHEMBL1114582 0.88 CA2 (0.48) CA1CA2PRSS1CTSGCTRB1
SCHEMBL22573795 0.86 PRSS1 (0.46) CA1CA2PRSS1CTSGCTRB1
SCHEMBL1067962 0.85 CHRM1 (0.34) CA1CA2PRSS1CTSGCTRB1
SCHEMBL27553218 0.85 ZDHHC7 (0.47) CA1CA2PRSS1CTSGCTRB1
SCHEMBL18097883 0.85 ZDHHC7 (0.47) CA1CA2PRSS1CTSGCTRB1
SCHEMBL5167002 0.85 ZDHHC7 (0.47) CA1CA2PRSS1CTSGCTRB1
SCHEMBL8976729 0.85 ZDHHC7 (0.47) CA1CA2PRSS1CTSGCTRB1
SCHEMBL5186285 0.85 ZDHHC7 (0.47) CA1CA2PRSS1CTSGCTRB1
SCHEMBL7613397 0.85 ZDHHC7 (0.47) CA1CA2PRSS1CTSGCTRB1
Hydrochloric Acid SCHEMBL28052365 0.83 ZDHHC7 (0.46) CA1CA2PRSS1CTSGCTRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993004-B2 Pest control composition CRODA, INC. (US) 2015-03-31 US claimed
US-20120251641-A1 METHODS FOR PEST CONTROL EMPLOYING MICROEMULSION-BASED ENHANCED PEST CONTROL FORMULATIONS TYRA TECH, INC, (US) 2012-10-04 US claimed
WO-2010115065-A2 METHODS FOR PEST CONTROL EMPLOYING MICROEMULSION-BASED ENHANCED PEST CONTROL FORMULATIONS TYRATECH, INC. (US) 2010-10-07 WO claimed
CN-101885999-B Clean methanol gasoline and preparation method thereof HENAN COAL CHEMICAL GROUP CO LTD 2013-12-11 CN disclosed
US-20120251641-A1 METHODS FOR PEST CONTROL EMPLOYING MICROEMULSION-BASED ENHANCED PEST CONTROL FORMULATIONS TYRA TECH, INC, (US) 2012-10-04 US disclosed
CN-101885999-A Clean methanol gasoline and preparation method thereof HENAN COAL CHEMICAL GROUP CO LTD 2010-11-17 CN disclosed
WO-2010115065-A2 METHODS FOR PEST CONTROL EMPLOYING MICROEMULSION-BASED ENHANCED PEST CONTROL FORMULATIONS TYRATECH, INC. (US) 2010-10-07 WO disclosed
CN-100400511-C Cathepsin S inhibitors BOEHRINGER INGELHEIM PHARMA (US) 2008-07-09 CN disclosed
CN-1761652-A Cathepsin S inhibitors BOEHRINGER INGELHEIM PHARMA (US) 2006-04-19 CN disclosed
EP-0339088-B1 IMPROVED TRACTION FUID Tonen Corporation (JP) 1993-04-21 EP disclosed
US-4978468-A A CYCLOHEXYL ESTER AND A CYCLOHEXYL ACRYLATE POLYMER TOA NENRYO KOGYO, K. K. (JP) 1990-12-18 US disclosed
EP-0339088-A1 IMPROVED TRACTION FUID Tonen Corporation (JP) 1989-11-02 EP disclosed