SCHEMBL9256933

SCHEMBL9256933

C=CC(N)c1cccc(C(N)C=C)c1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.36
F2 P00734 1/20 0.36
ADRB1 P08588 1/20 0.32
MIF P14174 1/20 0.32
HTR2A P28223 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
PGK1 P00558 3/20 0.32
PGK2 P07205 3/20 0.32

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
SCHEMBL5656923 0.89 RXRA (0.33) DPP4F2
SCHEMBL9301145 0.87 CYP3A4 (0.44)
SCHEMBL1419520 0.85 IDO1 (0.44)
SCHEMBL15771582 0.85 OPRM1 (0.41)
SCHEMBL16085848 0.85 TP53 (0.45)
SCHEMBL7595298 0.85 IDO1 (0.44)
SCHEMBL10723269 0.85 ADRB1 (0.52) ADRB1MIFHTR2AADRA1AHTR2B
SCHEMBL1534125 0.82 DPP4 (0.50) DPP4F2HTR2A
SCHEMBL1683556 0.82 DPP4 (0.50) DPP4F2HTR2A
SCHEMBL38740 0.82 DPP4 (0.50) DPP4F2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505889-B1 Aqueous dispersions of encapsulated polyisocyanates BAYER AG (US) 1995-10-18 EP disclosed
EP-0505873-B1 A process for sealing and/or priming concrete with aqueous polyisocyanate dispersions and the concrete obtained by this process BAYER AG (US) 1995-08-23 EP disclosed
EP-0505871-B1 Process for preparing and optionally chain extending aqueous polyisocyanate dispersions using static mixers BAYER AG (US) 1995-08-02 EP disclosed
EP-0505875-B1 Aqueous polyisocyanate dispersions with reduced isocyanate contents and their use for the production of fiberglass mats MILES INC (US) 1995-07-12 EP disclosed
US-5428124-A Urea and biuret liquid prepolymers of MDI MILES INC. (US) 1995-06-27 US disclosed
US-5391640-A A molding material blends consisting of a polyamide or a polylactam homopolymer and a polyamide copolymer which has aminoalkanoic acids, diamines and dicarboxylic acids monomer; vapor barriers; waterproofing, permselectivity ALLIEDSIGNAL INC. (US) 1995-02-21 US disclosed
US-5368806-A Polyurethanes with good molding properties and strength from diol and triols with isocyanates and amines MILES INC. (US) 1994-11-29 US disclosed
US-5221710-A PROCESS FOR PREPARING AND OPTIONALLY CHAIN EXTENDING AQUEOUS POLYISOCYANATE DISPERSIONS USING STATIC MIXERS MILES INC. (US) 1993-06-22 US disclosed
US-5191012-A AQUEOUS DISPERSIONS OF ENCAPSULATED POLYISOCYANATES MILES INC. (US) 1993-03-02 US disclosed
US-5185200-A AQUEOUS POLYISOCYANATE DISPERSIONS WITH REDUCED ISOCYANATE CONTENTS AND THEIR USE FOR THE PRODUCTION OF FIBERGLASS MATS MILES INC. (US) 1993-02-09 US disclosed
EP-0505889-A2 Aqueous dispersions of encapsulated polyisocyanates Bayer Corporation (US) 1992-09-30 EP disclosed
EP-0505871-A2 Process for preparing and optionally chain extending aqueous polyisocyanate dispersions using static mixers Bayer Corporation (US) 1992-09-30 EP disclosed
EP-0505875-A1 Aqueous polyisocyanate dispersions with reduced isocyanate contents and their use for the production of fiberglass mats Bayer Corporation (US) 1992-09-30 EP disclosed
EP-0505873-A1 A process for sealing and/or priming concrete with aqueous polyisocyanate dispersions and the concrete obtained by this process Bayer Corporation (US) 1992-09-30 EP disclosed
US-4324553-A OXIDATION COLOR DYES L'OREAL (FR) 1982-04-13 US disclosed