SCHEMBL645833

SCHEMBL645833

Cc1ccc(N=C=O)c(N=C=O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.50
TRPA1 O75762 1/20 0.48
TDP1 Q9NUW8 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
CYP1A2 P05177 2/20 0.35
CYP2A6 P11509 2/20 0.35
MAPT P10636 3/20 0.34
MAPK1 P28482 2/20 0.34
GAA P10253 2/20 0.34
ADRA2A P08913 1/20 0.34
PKM P14618 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
LMNA P02545 2/20 0.33
KDM4E B2RXH2 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
SCHEMBL30519851 1.00 CYP3A4 (0.50) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL11667358 0.94 CYP3A4 (0.48) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL9811585 0.90 CYP3A4 (0.42) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL31597 0.84 CYP3A4 (0.68) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL31115174 0.84 CYP3A4 (0.52) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL627870 0.84 CYP3A4 (0.52) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL608937 0.84 CYP3A4 (0.48) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL2489721 0.84 CYP3A4 (0.48) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL31115173 0.84 CYP3A4 (0.52) CYP3A4TRPA1TDP1ALDH1A1HPGD
SCHEMBL27918564 0.83 CYP3A4 (0.47) CYP3A4TRPA1TDP1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118307740-A Branched polyurethane, preparation method and application thereof, pole piece, secondary battery and power utilization device 宁德时代新能源科技股份有限公司 2024-07-09 CN claimed
CN-117736637-B Self-repairing waterproof paint and preparation method thereof 山东卓高新材料有限公司 2024-06-11 CN claimed
CN-117987065-A Adhesive containing antistatic agent compound and protective film adhesive tape 苏州世诺新材料科技有限公司 2024-05-07 CN claimed
CN-115368527-B Polyurethane foam material for cylindrical battery module and preparation method and application thereof 惠州亿纬锂能股份有限公司 2024-05-03 CN claimed
CN-117736637-A Self-repairing waterproof paint and preparation method thereof 山东卓高新材料有限公司 2024-03-22 CN claimed
CN-117567156-A Preparation process of high-strength ceramic product 揭阳市栢轩顺陶瓷有限公司 2024-02-20 CN claimed
CN-116640289-B Polyurethane material for controlled release fertilizer coating and preparation method and application thereof 安徽卓砺农业科技有限公司 2024-01-26 CN claimed
US-11879039-B1 Preparation method for thermoplastic multi-hybrid polyimide films HARBIN ENGINEERING UNIVERSITY (CN) 2024-01-23 US claimed
CN-115651593-B Hot melt adhesive for bonding polyester rubber elastic material and polycarbonate elastic material, and preparation method and application thereof 湖南柯盛新材料有限公司 2023-09-22 CN claimed
CN-116640289-A Polyurethane material for controlled release fertilizer coating and preparation method and application thereof 安徽卓砺农业科技有限公司 2023-08-25 CN claimed
US-20060247333-A1 Epoxy resin composition HUNTSMAN ADVANCED MATERIALS AMERICAS INC. (US) 2006-11-02 US claimed
EP-1252218-B1 EPOXY RESIN COMPOSITION HUNTSMAN ADV MAT SWITZERLAND (CH) 2006-09-27 EP claimed
CN-1275040-C Micro flow control chip of silicon rubber and method for face finish DALIAN INST CHEM & PHYSICS CAS (CN) 2006-09-13 CN claimed
CN-1255449-C Epoxy resin composition VANTICO AG (CH) 2006-05-10 CN claimed
CN-1218000-C Pigment dispersion resin for cathode electrophoresis paint and its pigment paste JIANGSU HONGYE COATING SCI & T (CN) 2005-09-07 CN claimed
CN-1627069-A Micro flow control chip of silicon rubber and method for face finish DALIAN INST CHEM & PHYSICS CAS (CN) 2005-06-15 CN claimed
US-20030149194-A1 Epoxy resin composition HUNTSMAN ADVANCED MATERIALS AMERICAS INC. (N/K/A HUNTSMAN ADVANCED MATERIALS AMERICAS LLC) 2003-08-07 US claimed
CN-1396938-A Epoxy resin composition VANTICO AG (CH) 2003-02-12 CN claimed
CN-1386815-A Preparing process and application of wet-solidifying single-component polyurethane adhesive CONG SHUFENG (CN) 2002-12-25 CN claimed
CN-1186550-A Polysiloxane polyhydric alcohol large molecule monomer, its manufacture and use CIBA GEIGY AG (CH) 1998-07-01 CN claimed