SCHEMBL5966

SCHEMBL5966

O=C=NCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 4/20 0.60
ALDH1A1 P00352 4/20 0.60
TRPA1 O75762 3/20 0.60
CYP3A4 P08684 1/20 0.60
HPGD P15428 1/20 0.60
CYP2E1 P05181 1/20 0.40
CYP2A6 P11509 1/20 0.40
HIF1A Q16665 1/20 0.40
CYP2A13 Q16696 1/20 0.40
EPAS1 Q99814 1/20 0.40
CALM1 P0DP23 1/20 0.39
GRIN1 Q05586 2/20 0.39
GRIN2B Q13224 2/20 0.39
NOS2 P35228 1/20 0.39
TSHR P16473 3/20 0.37
EPHX2 P34913 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
AKR1B1 P15121 1/20 0.37
IDO1 P14902 1/20 0.36

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
SCHEMBL1172136 1.00 MIF (0.60) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL1330511 1.00 MIF (0.60) MIFALDH1A1TRPA1CYP3A4HPGD
Ammonia Solution, Strong SCHEMBL8901629 0.98 MIF (0.58) MIFALDH1A1TRPA1CYP3A4HPGD
Hydrogen Sulfide SCHEMBL2772168 0.98 MIF (0.58) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL28217842 0.93 MIF (0.54) MIFALDH1A1TRPA1CYP3A4HPGD
Cyanide SCHEMBL28125462 0.93 ALDH1A1 (0.54) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL28983345 0.93 MIF (0.54) MIFALDH1A1TRPA1CYP3A4HPGD
Butane SCHEMBL27917654 0.91 ALDH1A1 (0.52) MIFALDH1A1TRPA1CYP3A4HPGD
SCHEMBL1162533 0.91 TRPA1 (0.52) MIFALDH1A1TRPA1CYP3A4HPGD
Benzylamine SCHEMBL25166822 0.89 LOXL2 (0.56) MIFALDH1A1TRPA1CYP3A4HPGD

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 9953 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059940-A Mountain lotus leaf essence urea derivative and preparation method and application thereof 南通大学 2026-05-19 CN claimed
CN-120310033-B PU-FC runway material with high mechanical strength and preparation method thereof 广东盛天体育股份有限公司 2026-05-19 CN claimed
WO-2026100817-A1 ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY COMPRISING SAME 동화일렉트로라이트 주식회사 2026-05-15 WO claimed
CN-117720140-B Superfine nickel oxide nano-particles, preparation method and dispersion method thereof 河北科技大学 2026-05-15 CN claimed
WO-2026087561-A1 RETARDING AGENT IN ISOCYANATE COMPONENT OF POLYURETHANE/UREA CEMENTITIOUS HYBRID SYSTEMS SIKA TECHNOLOGY AG (CH) 2026-04-30 WO claimed
EP-4733284-A1 RETARDING AGENT IN ISOCYANATE COMPONENT OF POLYURETHANE/UREA CEMENTITIOUS HYBRID SYSTEMS Sika Technology AG (CH) 2026-04-29 EP claimed
EP-4721152-A2 ORGANIC THIN FILM COATINGS FOR BATTERY MATERIALS Coreshell Technologies, Inc. (US) 2026-04-08 EP claimed
US-12509547-B2 Synthesis of linear polyoxazolidinones using uretdiones as diisocyanate component BASF SE (DE) 2025-12-30 US claimed
US-12359100-B2 System for producing a sealing compound for insulating glass IGK Isolierglasklebstoffe GmbH (DE) 2025-07-15 US claimed
WO-2025131930-A1 NON-AQUEOUS COATING COMPOSITION ALLNEX NETHERLANDS B.V. (NL) 2025-06-26 WO claimed
US-4544743-A Salts of 1,3,5-oxadiazines-2,4,6-triones, 1,3,5-oxadiazines-2,4,6-triones and the preparation thereof SOCIETE CARBOCHIMIQUE (BE) 1985-10-01 US claimed
EP-0088223-B1 MANUFACTURE OF ISOCYANATES AMERICAN CYANAMID COMPANY (US) 1985-04-17 EP claimed
EP-0129560-A4 MARINE ANTI-FOULING COATING COMPOSITION. DYCO CHEMICALS & COATINGS INC (US) 1985-04-03 EP claimed
EP-0129560-A1 MARINE ANTI-FOULING COATING COMPOSITION DYCO CHEMICALS & COATINGS INC. (US) 1985-01-02 EP claimed
EP-0021825-B1 POLYCAPROLACTONE POLYOL URETHANES AND PROCESSES FOR THEIR PRODUCTION UNION CARBIDE CORPORATION (US) 1984-09-26 EP claimed
WO-1984001785-A1 MARINE ANTI-FOULING COATING COMPOSITION DYCO CHEMICALS & COATINGS INC (US) 1984-05-10 WO claimed
EP-0098005-A2 1,3,5-Oxadiazine-2,4,6-trione salts, 1,3,5-oxadiazine-2,4,6-triones and their preparation SOCIETE CARBOCHIMIQUE en abrégé "CARBOCHIM" (BE) 1984-01-11 EP claimed
EP-0088223-A1 Manufacture of isocyanates AMERICAN CYANAMID COMPANY (US) 1983-09-14 EP claimed
US-4379767-A Manufacture of isocyanates AMERICAN CYANAMID COMPANY (US) 1983-04-12 US claimed
US-4361518-A REACTION OF TERT-BENZYL HALIDES WITH ISOCYANIC ACID AMERICAN CYANAMID COMPANY (US) 1982-11-30 US claimed