SCHEMBL21557

SCHEMBL21557

CCCCCC(CC)NC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.42
OPRM1 P35372 1/20 0.40
LMNA P02545 1/20 0.37
DNM1 Q05193 2/20 0.36
TSHR P16473 3/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 1/20 0.36
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH4 P08319 1/20 0.35
ADH7 P40394 1/20 0.35
THRB P10828 1/20 0.35
FDPS P14324 1/20 0.34
GPR84 Q9NQS5 2/20 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
SCHEMBL20840762 0.97 EPHX1 (0.46) EPHX1OPRM1LMNADNM1TSHR
SCHEMBL27325560 0.97 EPHX1 (0.46) EPHX1OPRM1LMNADNM1TSHR
SCHEMBL8332892 0.97 EPHX1 (0.46) EPHX1OPRM1LMNADNM1TSHR
SCHEMBL10700618 0.97 EPHX1 (0.46) EPHX1OPRM1LMNADNM1TSHR
SCHEMBL117988 0.97 EPHX1 (0.46) EPHX1OPRM1LMNADNM1TSHR
SCHEMBL30436843 0.97 EPHX1 (0.46) EPHX1OPRM1LMNADNM1TSHR
SCHEMBL13932787 0.97 EPHX1 (0.46) EPHX1OPRM1LMNADNM1TSHR
Hydrochloric Acid SCHEMBL28052855 0.97 EPHX1 (0.40) EPHX1OPRM1LMNADNM1TSHR
Hydrochloric Acid SCHEMBL27844743 0.95 EPHX1 (0.44) EPHX1OPRM1LMNADNM1TSHR
SCHEMBL7936451 0.92

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 78 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928246-B1 A SYNERGISTIC BIOCIDE AND PROCESS FOR CONTROLLING GROWTH OF MICROORGANISMS SOLENIS TECHNOLOGIES CAYMAN LP (CH) 2016-08-24 EP claimed
US-8613859-B2 Synergistic biocide and process for controlling growth of microoganisms HERCULES INCORPORATED (US) 2013-12-24 US claimed
CN-101296621-B Synergistic antimicrobial agent and method for controlling microbial growth HERCULES INC 2012-05-30 CN claimed
US-20110159117-A1 Synergistic Biocide and Process for Controlling Growth of Microoganisms THE BANK OF NEW YORK MELLON TRUST COMPANY, N.A., AS NOTES COLLATERAL AGENT 2011-06-30 US claimed
CN-101296862-B Method for producing synergistic biocide HERCULES INC 2011-06-15 CN claimed
EP-1928784-B1 METHOD AND APPARATUS FOR PRODUCING SYNERGISTIC BIOCIDE HERCULES INC (US) 2009-10-14 EP claimed
CN-101296621-A Synergistic antimicrobial agent and method for controlling microbial growth HERCULES INC (US) 2008-10-29 CN claimed
CN-101296862-A Method and apparatus for producing synergistic biocide HERCULES INC (US) 2008-10-29 CN claimed
EP-1928246-A2 A SYNERGISTIC BIOCIDE AND PROCESS FOR CONTROLLING GROWTH OF MICROORGANISMS Hercules Incorporated (US) 2008-06-11 EP claimed
EP-1928784-A2 METHOD AND APPARATUS FOR PRODUCING SYNERGISTIC BIOCIDE Hercules Incorporated (US) 2008-06-11 EP claimed
US-7311878-B2 Contacting ammonium or amine compound such as ammonia or ammonium hydroxide with halogenated oxidant in water to produce monohaloamine; converting portion of monohaloamine to dihaloamine by reducing the pH; papermaking; haloamination HERCULES INCORPORATED (US) 2007-12-25 US claimed
CN-1325388-C Synergistic biocidal mixtures HERCULES INC (US) 2007-07-11 CN claimed
WO-2007025184-A2 METHOD AND APPARATUS FOR PRODUCING SYNERGISTIC BIOCIDE HERCULES INCORPORATED (US) 2007-03-01 WO claimed
WO-2007025087-A2 A SYNERGISTIC BIOCIDE AND PROCESS FOR CONTROLLING GROWTH OF MICROORGANISMS HERCULES INCORPORATED (US) 2007-03-01 WO claimed
US-20070049642-A1 Method and apparatus for producing synergistic biocide THE BANK OF NEW YORK MELLON TRUST COMPANY, N.A., AS NOTES COLLATERAL AGENT 2007-03-01 US claimed
US-20070045199-A1 Synergistic biocide and process for controlling growth of microorganisms BIRKO CORPORATION 2007-03-01 US claimed
CN-1678534-A Synergistic biocidal mixtures HERCULES INC (US) 2005-10-05 CN claimed
WO-2004018368-A1 SYNERGISTIC BIOCIDAL MIXTURES HERCULES INCORPORATED (US) 2004-03-04 WO claimed
US-20040035803-A1 Synergistic biocidal mixtures SOLENIS TECHNOLOGIES, L.P. 2004-02-26 US claimed
EP-1391430-A1 Synergistic biocidal mixtures HERCULES INCORPORATED (US) 2004-02-25 EP claimed