SCHEMBL5160753

SCHEMBL5160753

CC(N=NC(C)(C(=N)N)C1CC1)(C(=N)N)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
CYP2D6 P10635 1/20 0.42
NOS2 P35228 1/20 0.31

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
SCHEMBL5160743 1.00 ALDH1A1 (0.42) ALDH1A1CYP3A4MAPTCYP2D6NOS2
SCHEMBL11316747 0.89 ALDH1A1 (0.38) ALDH1A1CYP3A4MAPTCYP2D6NOS2
SCHEMBL11316752 0.89 ALDH1A1 (0.38) ALDH1A1CYP3A4MAPTCYP2D6NOS2
SCHEMBL11528167 0.76 EPHX1 (0.31)
SCHEMBL11528165 0.76 EPHX1 (0.31)
SCHEMBL24760153 0.70
SCHEMBL17763170 0.70
Hydrochloric Acid SCHEMBL29112636 0.68 ALDH1A1 (0.39) ALDH1A1CYP3A4MAPTCYP2D6NOS2
SCHEMBL9067197 0.68 ALDH1A1 (0.35) ALDH1A1
SCHEMBL7722073 0.66 MEN1 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070254976-A1 Method For Production Of Cement Dispersant And Polycarboxylic Acid Type Polymer For Cement Dispersant NIPPON SHOKUBAI CO., LTD. (JP) 2007-11-01 US disclosed
US-7230061-B2 Process for production of water-soluble (meth)acrylic polymers, water-soluble (meth)acrylic polymers, and use thereof NIPPON SHOKUBAI CO., LTD. (JP) 2007-06-12 US disclosed
EP-1454928-B1 PROCESS FOR PRODUCTION OF WATER-SOLUBLE (METH)ACRYLIC POLYMERS, WATER-SOLUBLE (METH)ACRYLIC POLYMERS, AND USE THEREOF NIPPON CATALYTIC CHEM IND (JP) 2007-02-28 EP disclosed
US-20060173088-A1 Method for production of water-soluble porous polymer and water-soluble porous polymer NIPPON SHOKUBAI CO., LTD. (JP) 2006-08-03 US disclosed
EP-1454928-A1 PROCESS FOR PRODUCTION OF WATER−SOLUBLE (METH)ACRYLIC POLYMERS, WATER−SOLUBLE (METH)ACRYLIC POLYMERS, AND USE THEREOF Nippon Shokubai Co., Ltd. (JP) 2004-09-08 EP disclosed
US-20040110861-A1 Process for production of water-soluble (meth)acrylic polymers, water-soluble (meth) acrylic polymers, and use thereof NIPPON SHOKUBAI CO., LTD. (JP) 2004-06-10 US disclosed
US-4260713-A AZOBIS/N,N*DIMETHYLENEISOBUTYLAMIDINE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1981-04-07 US disclosed