SCHEMBL27529902

SCHEMBL27529902

CCCC(O)([C](O)O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
SIGMAR1 Q99720 2/20 0.43
CYP2C19 P33261 6/20 0.42
LMNA P02545 3/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GAA P10253 1/20 0.42
ALOX12 P18054 1/20 0.42
CYP1A2 P05177 3/20 0.41
CYP2C9 P11712 3/20 0.41
KCNN4 O15554 1/20 0.41
CHRM2 P08172 3/20 0.40
CHRM4 P08173 3/20 0.40
CHRM5 P08912 3/20 0.40
CHRM1 P11229 3/20 0.40
CHRM3 P20309 3/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
CYP2D6 P10635 3/20 0.39
CYP3A4 P08684 2/20 0.39

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
SCHEMBL8015531 0.85 CYP2C19 (0.46) SMN1; SMN2SIGMAR1CYP2C19LMNAHTT
SCHEMBL19205720 0.81 SCN5A (0.54) SIGMAR1CYP2C19LMNAHTTL3MBTL1
SCHEMBL4862217 0.81 SMN1; SMN2 (0.59) SMN1; SMN2SIGMAR1LMNACHRM2CHRM4
SCHEMBL9194705 0.81 CYP2C19 (0.52) SMN1; SMN2SIGMAR1CYP2C19LMNAHTT
SCHEMBL297345 0.81 CYP2C19 (0.46) SMN1; SMN2SIGMAR1CYP2C19LMNAHTT
SCHEMBL7459315 0.81 SMN1; SMN2 (0.44) SMN1; SMN2SIGMAR1CYP2C19LMNAHTT
SCHEMBL10617967 0.81 CYP2C19 (0.46) SMN1; SMN2SIGMAR1CYP2C19LMNAHTT
SCHEMBL452703 0.80 CES1 (0.49) SIGMAR1CYP2C19LMNAHTTL3MBTL1
SCHEMBL8370180 0.79 KCNN4 (0.44) SMN1; SMN2SIGMAR1CYP2C19LMNAHTT
SCHEMBL11329310 0.78 KCNN4 (0.56) SIGMAR1CYP2C19LMNAHTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103619948-A Polymeric water repellent material LG CHEMICAL LTD 2014-03-05 CN claimed
CN-103443217-B ink and printing process FUJIFILM IMAGING COLORANTS, INC. (US) 2016-01-20 CN disclosed
CN-104704011-A (Meth)acrylate composition AUTONETWORKS TECHNOLOGIES LTD 2015-06-10 CN disclosed
CN-103619948-A Polymeric water repellent material LG CHEMICAL LTD 2014-03-05 CN disclosed
CN-103443217-A ink and printing process FUJIFILM IMAGING COLORANTS LTD 2013-12-11 CN disclosed
CN-102083925-B Binder for antifouling coating composition and antifouling coating composition comprising binder JOTUN AS 2013-11-06 CN disclosed
CN-102532429-A Energy ray-curable resin composition for optical lens sheet and cured product thereof, and the optical lens sheet NIPPON KAYAKU KK 2012-07-04 CN disclosed
CN-102498146-A Polymer compositions and methods of making and using the same POLYMERIGHT INC 2012-06-13 CN disclosed
CN-101096564-B Paint for transparent film and transparent film coated substrate CATALYSTS & CHEM IND CO 2011-11-09 CN disclosed
CN-102083925-A Binder for antifouling coating composition and antifouling coating composition comprising binder JOTUN AS 2011-06-01 CN disclosed
CN-101096564-A Paint for transparent film and transparent film coated substrate CATALYSTS & CHEM IND CO (JP) 2008-01-02 CN disclosed
CN-100348643-C Method for preparing metal cyanide catalysts using polymerizable complexing agents DOW GLOBAL TECHNOLOGIES INC (US) 2007-11-14 CN disclosed
CN-1856555-A Process for the preparation of surface coatings and films DISPERSE LTD (GB) 2006-11-01 CN disclosed
CN-1735647-A Method for preparing metal cyanide catalysts using polymerizable complexing agents DOW GLOBAL TECHNOLOGIES INC (US) 2006-02-15 CN disclosed
CN-1063470-C Marking composition and marking method NIPPON KAYAKU KK (JP) 2001-03-21 CN disclosed
CN-1129458-A Marking composition and marking method NIPPON KAYAKU KK (JP) 1996-08-21 CN disclosed