SCHEMBL6152942

SCHEMBL6152942

CC(C)(N=NC(C)(C)C(=N)N)C(=N)N.CC(C)(N=NC(C)(C)C(=N)N)C(=N)N

nearest known ligand 0.94

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.94
CYP3A4 P08684 1/20 0.94
MAPT P10636 1/20 0.94
CYP2D6 P10635 1/20 0.94
NOS1 P29475 2/20 0.36
MAPK1 P28482 1/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 1/20 0.30

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
SCHEMBL246819 1.00 ALDH1A1 (0.94) ALDH1A1CYP3A4MAPTCYP2D6NOS1
SCHEMBL246818 1.00 ALDH1A1 (0.94) ALDH1A1CYP3A4MAPTCYP2D6NOS1
Water SCHEMBL9768915 0.97 ALDH1A1 (0.88) ALDH1A1CYP3A4MAPTCYP2D6NOS1
Hydrochloric Acid SCHEMBL34438 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPTCYP2D6NOS1
Hydrochloric Acid SCHEMBL276014 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPTCYP2D6NOS1
Hydrochloric Acid SCHEMBL23478926 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPTCYP2D6NOS1
Water SCHEMBL11529481 0.97 ALDH1A1 (0.88) ALDH1A1CYP3A4MAPTCYP2D6NOS1
Water SCHEMBL9768923 0.97 ALDH1A1 (0.88) ALDH1A1CYP3A4MAPTCYP2D6NOS1
Hydrochloric Acid SCHEMBL954633 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPTCYP2D6NOS1
Hydrochloric Acid SCHEMBL738578 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPTCYP2D6NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1023341-A1 METHOD FOR PRODUCING ANIONICALLY MODIFIED POLYMERIZATES OF ALKYL-1-VINYL-IMIDAZOLES BASF AKTIENGESELLSCHAFT (DE) 2000-08-02 EP claimed
WO-1999016798-A1 METHOD FOR PRODUCING ANIONICALLY MODIFIED POLYMERIZATES OF ALKYL-1-VINYL-IMIDAZOLES BASF AKTIENGESELLSCHAFT (DE) 1999-04-08 WO claimed
EP-1500666-A2 Use of C4-C6-polymercaptopolyols as regulator in solution or precipitation polymerisation BASF AKTIENGESELLSCHAFT (DE) 2005-01-26 EP disclosed
EP-0939641-B1 TOPICAL PRODUCTS AS PROPHYLACTIC OR CURATIVE AGENTS FOR BACTERIAL SKIN INFECTIONS BASF AG (DE) 2003-05-28 EP disclosed
EP-0866811-B1 METHOD FOR THE MANUFACTURE OF LOW VISCOSITY AQUEOUS POLYMER DISPERSIONS WITH A POLYMER CONTENT OF AT LEAST 50 VOLUME % BASF AG (DE) 2002-05-29 EP disclosed
EP-0781787-B1 Heavy metal ions-polymer complexes and their use for selective removal of compounds from liquids BASF AG (DE) 2000-09-13 EP disclosed
EP-1023341-A1 METHOD FOR PRODUCING ANIONICALLY MODIFIED POLYMERIZATES OF ALKYL-1-VINYL-IMIDAZOLES BASF AKTIENGESELLSCHAFT (DE) 2000-08-02 EP disclosed
EP-0641521-B1 Process for the removal of aluminium ions from beverages BASF AG (DE) 1999-05-06 EP disclosed
EP-0848723-B1 POWDERY POROUS POLYMERS CONTAINING N-VINYLIMIDAZOL UNITS, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AG (DE) 1999-04-21 EP disclosed
WO-1999016798-A1 METHOD FOR PRODUCING ANIONICALLY MODIFIED POLYMERIZATES OF ALKYL-1-VINYL-IMIDAZOLES BASF AKTIENGESELLSCHAFT (DE) 1999-04-08 WO disclosed
EP-0867455-A2 Aqueous copolymer dispersions of water-soluble monomers with N-vinyl group and hydrophobe monomers BASF AKTIENGESELLSCHAFT (DE) 1998-09-30 EP disclosed
EP-0572994-B1 Process for the preparation of urethdione groups-containing polyisocyanates BASF AG (DE) 1996-01-17 EP disclosed
EP-0687694-A2 Process for producing polymerizates based on 1-vinylimidazoles BASF AKTIENGESELLSCHAFT (DE) 1995-12-20 EP disclosed
WO-1995025135-A1 POLYMERS OF UNSATURATED SACCHARIDES AND THEIR DERIVATIVES AND THEIR COPOLYMERS HAVING ETHYLENICALLY UNSATURATED COMPOUNDS, AND PROCESS FOR PREPARING THEM VEREIN DER ZUCKERINDUSTRIE (DE) 1995-09-21 WO disclosed
EP-0641521-A1 Process for the removal of aluminium ions from beverages BASF Aktiengesellschaft (DE) 1995-03-08 EP disclosed
EP-0438713-B1 Method for removing heavy metal ions from wine and related drinks BASF AG (DE) 1995-03-08 EP disclosed
EP-0572994-A1 Process for the preparation of urethdione groups-containing polyisocyanates BASF Aktiengesellschaft (DE) 1993-12-08 EP disclosed
EP-0526800-A1 Polymers from N-containing monomers polymerised in the presence of monosaccharids, oligosaccharids or polysaccharids and derivatives BASF Aktiengesellschaft (DE) 1993-02-10 EP disclosed
EP-0438713-A2 Method for removing heavy metal ions from wine and related drinks BASF Aktiengesellschaft (DE) 1991-07-31 EP disclosed
EP-0088964-B1 PROCESS FOR PREPARING INSOLUBLE, ONLY SLIGHTLY EXPANDABLE POLYMERS OF BASIC VINYL-HETEROCYCLIC COMPOUNDS, AND THEIR USE BASF Aktiengesellschaft (DE) 1987-09-02 EP disclosed