SCHEMBL19003392

SCHEMBL19003392

Cc1cc(O)c(O)c(C)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.48
SELP P16109 1/20 0.48
SELE P16581 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
MAPT P10636 5/20 0.46
KDM4E B2RXH2 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
USP2 O75604 1/20 0.46
HTT P42858 1/20 0.46
ALDH1A1 P00352 4/20 0.43
HPGD P15428 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
G6PD P11413 1/20 0.43

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
SCHEMBL6254955 0.84 SELL (0.56) SELLSELPSELECA1CA2
SCHEMBL68382 0.84 CA1 (0.56) SELLSELPSELECA1CA2
SCHEMBL2912790 0.82 SELL (0.48) SELLSELPSELECA1CA2
SCHEMBL2562811 0.82 ACHE (0.48) SELLSELPSELECA1CA2
SCHEMBL70458 0.82 ACHE (0.48) SELLSELPSELECA1CA2
SCHEMBL29372751 0.82 ACHE (0.48) SELLSELPSELECA1CA2
SCHEMBL3680700 0.80 MAPT (0.56) SELLSELPSELECA1CA2
SCHEMBL30058203 0.80 MAPT (0.56) SELLSELPSELECA1CA2
SCHEMBL634558 0.79 SELL (0.50) SELLSELPSELECA1CA2
Ethylbenzene SCHEMBL27507541 0.78 TP53 (0.50) MAPTKDM4EMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180273722-A1 RESIN COMPOSITION ZEON CORPORATION (JP) 2018-09-27 US disclosed
EP-3345971-A1 RESIN COMPOSITION Zeon Corporation (JP) 2018-07-11 EP disclosed
CN-107603991-A A kind of Catechol 2,3 dioxygenase genes and its application 河南科技大学 2018-01-19 CN disclosed
WO-2017106861-A1 COMPOSITIONS OF POLYHYDROXYLATED BENZOPHENONES AND METHODS OF TREATMENT OF NEURODEGENERATIVE DISORDERS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-06-22 WO disclosed
CN-102015695-B Pyridin-2-yl derivatives as immunomodulating agents ACTELION PHARMACEUTICALS LTD 2014-08-27 CN disclosed
CN-102007107-B Novel aminomethyl benzene derivatives ACTELION PHARMACEUTICALS LTD 2014-07-23 CN disclosed
CN-101627034-B amino-pyridine derivatives as S1P1/EDG1 receptor agonists ACTELION PHARMACEUTICALS LTD 2013-05-15 CN disclosed
CN-101896482-B Thiophene derivatives as S1P1/EDG1 agonists ACTELION PHARMACEUTICALS LTD 2013-01-09 CN disclosed
CN-101522645-B Phenyl derivatives and their use as immunomodulators ACTELION PHARMACEUTICALS LTD 2013-01-09 CN disclosed
CN-101522670-B Pyridin-3-yl derivatives as immunomodulators ACTELION PHARMACEUTICALS LTD 2012-05-23 CN disclosed
CN-101511827-B Pyridin-4-yl derivatives as immunomodulating agents ACTELION PHARMACEUTICALS LTD. (CH) 2012-02-01 CN disclosed
CN-102015695-A Pyridin-2-yl derivatives as immunomodulating agents ACTELION PHARMACEUTICALS LTD 2011-04-13 CN disclosed
CN-102007107-A Novel aminomethyl benzene derivatives ACTELION PHARMACEUTICALS LTD 2011-04-06 CN disclosed
CN-101965345-A pyridine compound ACTELION PHARMACEUTICALS LTD 2011-02-02 CN disclosed
CN-101896482-A Thiophene derivatives as S1P1/EDG1 agonists ACTELION PHARMACEUTICALS LTD 2010-11-24 CN disclosed
CN-101627034-A Amino-pyridine derivatives as S1P1/EDG1 receptor agonists ACTELION PHARMACEUTICALS LTD 2010-01-13 CN disclosed
CN-101522645-A Phenyl derivatives and their use as immunomodulators ACTELION PHARMACEUTICALS LTD (CH) 2009-09-02 CN disclosed
CN-101522670-A Pyridin-3-yl derivatives as immunomodulators ACTELION PHARMACEUTICALS LTD (CH) 2009-09-02 CN disclosed
CN-101511827-A Pyridin-4-yl derivatives as immunomodulating agents ACTELION PHARMACEUTICALS LTD (CH) 2009-08-19 CN disclosed