SCHEMBL461687

SCHEMBL461687

C=CC=CC(C=CC#N)=C(C=Cc1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.37
CYP1B1 Q16678 4/20 0.37
LMNA P02545 3/20 0.37
MAOB P27338 3/20 0.37
PLIN1 O60240 2/20 0.37
RECQL P46063 2/20 0.37
PLIN5 Q00G26 2/20 0.37
ABHD5 Q8WTS1 2/20 0.37
BCHE P06276 1/20 0.37
TNFRSF1A P19438 1/20 0.37
ACHE P22303 1/20 0.37
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP3A4 P08684 4/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 2/20 0.33
F3 P13726 2/20 0.33
NFKB1 P19838 2/20 0.33
RAB9A P51151 2/20 0.33
NFKB2 Q00653 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
SCHEMBL1003800 0.89 CYP1B1 (0.46) MAPTCYP1B1LMNAMAOBPLIN1
SCHEMBL5146781 0.87 CYP1B1 (0.44) MAPTCYP1B1LMNAMAOBPLIN1
SCHEMBL27184 0.84 CYP1B1 (0.44) MAPTCYP1B1LMNAMAOBPLIN1
SCHEMBL251132 0.84 AKT1 (0.33) MAPTLMNAALDH1A1L3MBTL1NFKB1
SCHEMBL3939691 0.83 MAPT (0.43) MAPTCYP1B1LMNAMAOBPLIN1
SCHEMBL17746649 0.83 LMNA (0.39) MAPTCYP1B1LMNAMAOBPLIN1
SCHEMBL1552201 0.81 AKT1 (0.33) MAPTLMNAALDH1A1L3MBTL1NFKB1
Styrene SCHEMBL1946755 0.80 ALDH1A1 (0.42) MAPTCYP1B1LMNAMAOBPLIN1
SCHEMBL624043 0.80 GLA (0.41) MAPTCYP1B1LMNAMAOBPLIN1
SCHEMBL1686029 0.80 CYP1B1 (0.43) MAPTCYP1B1LMNAMAOBPLIN1

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-20230348326-A1 CONSTRUCTION MATERIALS, COMPOSITIONS AND METHODS OF MAKING SAME S&E INNOVATIVE TECHNOLOGIES LLC. (US) 2023-11-02 US disclosed
US-11572309-B2 Construction materials, compositions and methods of making same S&E INNOVATIVE TECHNOLOGIES LLC (US) 2023-02-07 US disclosed
EP-3635059-A1 CONSTRUCTION MATERIALS, COMPOSITIONS AND METHODS OF MAKING SAME S&E Innovative Technologies LLC (US) 2020-04-15 EP disclosed
US-20200071230-A1 CONSTRUCTION MATERIALS, COMPOSITIONS AND METHODS OF MAKING SAME S&E INNOVATIVE TECHNOLOGIES LLC (US) 2020-03-05 US disclosed
WO-2018217716-A1 CONSTRUCTION MATERIALS, COMPOSITIONS AND METHODS OF MAKING SAME S&E INNOVATIVE TECHNOLOGIES LLC (US) 2018-11-29 WO disclosed
EP-2614040-B1 CONSTRUCTION MATERIALS AND COMPOSITIONS FROM OIL-CONTAINING FILLER S&E INNOVATIVE TECH LLC (US) 2017-04-12 EP disclosed
WO-2015127561-A1 POLYMER MODIFIED ASPHALT COMPOSITIONS UTILIZING AN IONOMERIC ELASTOMER AND METHODS OF PREPARATION FOR CRACK AND JOINT SEALERS LANXESS INC. (CA) 2015-09-03 WO disclosed
WO-2015127562-A1 ASPHALT ADHESIVE COMPOSITION UTILIZING AN IONOMERIC ELASTOMER LANXESS INC. (CA) 2015-09-03 WO disclosed
US-8591646-B2 Construction materials and compositions from oil-containing filler S&E INNOVATIVE TECHNOLOGIES LLC (US) 2013-11-26 US disclosed
US-20130233206-A1 CONSTRUCTION MATERIALS AND COMPOSITIONS FROM OIL-CONTAINING FILLER S&E INNOVATIVE TECHNOLOGIES LLC 2013-09-12 US disclosed
EP-2614040-A1 CONSTRUCTION MATERIALS AND COMPOSITIONS FROM OIL-CONTAINING FILLER S&E Innovative Technologies LLC (US) 2013-07-17 EP disclosed
WO-2012033617-A1 CONSTRUCTION MATERIALS AND COMPOSITIONS FROM OIL-CONTAINING FILLER MONTE SALVATORE J (US) 2012-03-15 WO disclosed
EP-0240137-B1 Repolymerization KENRICH PETROCHEMICALS (US) 1998-08-05 EP disclosed
EP-0164227-B1 NEOALKOXY ORGANO-TITANATES AND ORGANO-ZIRCONATES USEFUL AS COUPLING AND POLYMER PROCESSING AGENTS KENRICH PETROCHEMICALS, INC. (US) 1990-08-16 EP disclosed
EP-0240137-A2 Repolymerization KENRICH PETROCHEMICALS, INC. (US) 1987-10-07 EP disclosed
US-4657988-A NEOALKOXY ZIRCONATE OR TITANATE ADDITIVES; ISOMERIZATION, REARRANGEMENT; POLYETHERS, POLYESTERS, POLYURETHANES KENRICH PETROCHEMICALS, INC. (US) 1987-04-14 US disclosed
US-4623738-A ANCHORING FILLER TO POLYMER KENRICH PETROCHEMICALS, INC. (US) 1986-11-18 US disclosed
US-4600789-A Neoalkoxy organo-titanate useful as coupling and polymer processing agents KENRICH PETROCHEMICALS, INC. (US) 1986-07-15 US disclosed
EP-0164227-A2 Neoalkoxy organo-titanates and organo-zirconates useful as coupling and polymer processing agents KENRICH PETROCHEMICALS, INC. (US) 1985-12-11 EP disclosed