SCHEMBL15435

SCHEMBL15435

Cc1cc(N=C=O)c(Cc2cc(N=C=O)c(C)cc2N=C=O)cc1N=C=O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.48
TRPA1 O75762 1/20 0.48
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TSHR P16473 1/20 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
SCHEMBL29381038 1.00 CYP3A4 (0.48) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL941548 0.88 CYP3A4 (0.48) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL7040836 0.86 CYP3A4 (0.41) CYP3A4TRPA1
SCHEMBL1044718 0.85 CYP3A4 (0.61) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL375132 0.81 CYP3A4 (0.57) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL1191608 0.81 CYP3A4 (0.57) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL1045246 0.78 CYP3A4 (0.59) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL11855022 0.78 CYP3A4 (0.41) CYP3A4TRPA1GABRA1GABRB2ALDH1A1
SCHEMBL9694213 0.77 CYP3A4 (0.53) CYP3A4TRPA1ALDH1A1HPGDTDP1
SCHEMBL20272490 0.77 CYP3A4 (0.42) CYP3A4TRPA1GABRA1GABRB2ALDH1A1

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

Appears in 2432 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4377369-A1 METHOD FOR PRODUCING A MIXTURE OF ALKOXYLATED POLYPHENOLS AND USE OF SAID MIXTURE SOPREMA (FR) 2024-06-05 EP claimed
WO-2023227840-A1 RECYCLING POLYOLS PRODUCED FROM MOLDED POLYURETHANE FOAM Faurecia Sièges d'Automobile (FR) 2023-11-30 WO claimed
WO-2023227841-A1 RECYCLING POLYOLS PRODUCED FROM SEAT COVER MATERIALS Faurecia Sièges d'Automobile (FR) 2023-11-30 WO claimed
EP-3947528-B1 SYSTEM FOR PRODUCING A SEALING COMPOUND FOR INSULATING GLASS IGK Isolierglasklebstoffe GmbH (DE) 2023-06-07 EP claimed
WO-2023007103-A1 METHOD FOR PRODUCING A MIXTURE OF ALKOXYLATED POLYPHENOLS AND USE OF SAID MIXTURE SOPREMA (FR) 2023-02-02 WO claimed
WO-2022260859-A1 HCFO-CONTAINING ISOCYANATE-REACTIVE COMPOSITIONS, RELATED FOAM-FORMING COMPOSITIONS AND FLAME RETARDANT PUR-PIR FOAMS COVESTRO LLC (US) 2022-12-15 WO claimed
US-20220195263-A1 SYSTEM FOR PRODUCING A SEALING COMPOUND FOR INSULATING GLASS IGK Isolierglasklebstoffe GmbH (DE) 2022-06-23 US claimed
EP-2340271-B1 POLYMER-BIOACTIVE AGENT CONJUGATES POLYACTIVA PTY LTD (AU) 2018-12-05 EP claimed
US-20180162987-A1 DEGRADABLE POLYURETHANES AND COMPOSITES THEREOF ADESSO ADVANCED MATERIALS WUHU CO., LTD. (CN) 2018-06-14 US claimed
US-9834638-B2 Process for preparing rigid polyisocyanurate foams using natural-oil polyols COVESTRO LLC (US) 2017-12-05 US claimed
WO-2003099893-A1 RIGID POLYURETHANE FOAMS FOR INSULATION AND PROCESS FOR PRODUCING SAME BAYER MATERIALSCIENCE LLC (US) 2003-12-04 WO claimed
US-20030220409-A1 Rigid polyurethane foams for insulation and process for producing same BAYER MATERIALSCIENCE LLC 2003-11-27 US claimed
US-6486266-B2 POLYCARBODIIMIDES NISSHINBO INDUSTRIES, INC. (JP) 2002-11-26 US claimed
US-5785423-A Continuous emulsification tank and process FUJI PHOTO FILM CO., LTD. (JP) 1998-07-28 US claimed
US-5539006-A CLOSED CELL POLYURETHANE FORMED FROM POLYISOCYANATES, SUCROSE, ETHYLENE OXIDE AND PROPYLENE OXIDE POLYETHER, BLOWING AGENT AND CATALYST BAYER CORPORATION (US) 1996-07-23 US claimed
EP-0496848-B1 MICROFIBERS OF RIGID POLYURETHANE HAVING LARGE AMOUNT OF HARD SEGMENT, NONWOVEN MATS OF THE MICROFIBERS AND MELT-BLOWING PROCESS FOR THE PRODUCTION THEREOF DOW CHEMICAL CO (US) 1996-02-21 EP claimed
US-5389490-A Capsule toner and process for producing the same FUJI XEROX CO., LTD. (JP) 1995-02-14 US claimed
US-5344484-A Decorative door skin MASONITE CORPORATION (US) 1994-09-06 US claimed
US-4369302-A Curable resin composition comprising cyanate ester and polyisocyanate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-01-18 US claimed
US-4048253-A HEAT TREATMENT FUJI PHOTO FILM CO., LTD. (JA) 1977-09-13 US claimed