SCHEMBL30032

SCHEMBL30032

c1cncc(-c2cccnc2-c2cccnc2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.64
CYP2A6 P11509 8/20 0.63
CYP3A4 P08684 3/20 0.56
ALDH1A1 P00352 2/20 0.56
CYP1A2 P05177 2/20 0.56
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CYP11B1 P15538 2/20 0.47
CYP11B2 P19099 1/20 0.47
NUDT1 P36639 1/20 0.46
TDO2 P48775 2/20 0.46
CYP2E1 P05181 1/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL31635952 1.00 PTGS2 (0.64) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
SCHEMBL28181896 1.00 PTGS2 (0.64) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
SCHEMBL16026561 0.98 PTGS2 (0.62) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
SCHEMBL16026727 0.98 PTGS2 (0.62) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
SCHEMBL5395875 0.98 PTGS2 (0.62) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
Benzene SCHEMBL9109284 0.98 PTGS2 (0.62) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
SCHEMBL1323698 0.98 PTGS2 (0.62) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
SCHEMBL16026628 0.98 PTGS2 (0.62) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
SCHEMBL16026793 0.98 PTGS2 (0.62) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2
SCHEMBL1777671 0.98 PTGS2 (0.62) PTGS2CYP2A6CYP3A4ALDH1A1CYP1A2

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 4230 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637460-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2026-05-26 US claimed
CN-122025743-A Low-temperature-resistant high-rate charge-discharge sodium ion startup and shutdown battery and preparation method thereof 江苏传艺科技股份有限公司 2026-05-12 CN claimed
CN-122005879-A Modified GRPR antagonist peptides for cancer imaging and treatment 慕尼黑工业大学 2026-05-12 CN claimed
CN-117402106-B Multidentate organic ligand containing triphenylamine-terpyridine structure, metal supermolecular polymer, polymer film and preparation method 吉林大学 2026-05-12 CN claimed
US-20250295029-A1 Organic Light Emitting Diode and Device Comprising the Same NOVALED GMBH (DE) 2025-09-18 US claimed
CN-120136852-A Heterocyclic compound, organic electroluminescent element, and electronic device 海宁奕诺炜特科技有限公司 2025-06-13 CN claimed
CN-120081841-A Benzimidazole derivative and organic electroluminescent element comprising same 海宁奕诺炜特科技有限公司 2025-06-03 CN claimed
CN-120025355-A Condensed ring compound, organic electroluminescent device and electronic equipment 海宁奕诺炜特科技有限公司 2025-05-23 CN claimed
CN-119432016-A Impact-resistant packaging material and preparation method thereof 武汉环动科技发展有限公司 2025-02-14 CN claimed
CN-119285656-A Rare earth complex fluorescent material, ultrasonic synthesis method and application thereof 河北师范大学 2025-01-10 CN claimed
WO-1991016719-A2 PHOTOVOLTAIC CELLS GRAETZEL MICHAEL (CH) 1991-10-31 WO claimed
CN-1042723-A Contain the photosensitive composition of transition metal coordination complex cation and acid anion and contain the photochromics of said composition MEAD CORP (US) 1990-06-06 CN claimed
EP-0339086-A4 ELECTROCHEMILUMINESCENT RHENIUM MOIETIES AND METHODS. IGEN INC (US) 1990-02-20 EP claimed
EP-0339086-A1 ELECTROCHEMILUMINESCENT RHENIUM MOIETIES AND METHODS IGEN, INC. (US) 1989-11-02 EP claimed
CN-1036688-A PORPHYRIC INSECTICIDES UNIV ILLINOIS (US) 1989-11-01 CN claimed
WO-1989004302-A1 ELECTROCHEMILUMINESCENT RHENIUM MOIETIES AND METHODS IGEN, INC. (US) 1989-05-18 WO claimed
EP-0097592-B1 PROCESS FOR CATALYTICALLY REDUCING NITROAROMATIC COMPOUNDS Montedison S.p.A. (IT) 1986-12-10 EP claimed
WO-1986002734-A1 LUMINESCENT METAL CHELATE LABELS AND MEANS FOR DETECTION HYPERION CATALYSIS INTERNATIONAL, INC. (US) 1986-05-09 WO claimed
US-4535162-A USING GROUP 8 METAL COORDINATION CATALYSTS MONTEDISON S.P.A. (IT) 1985-08-13 US claimed
EP-0097592-A2 Process for catalytically reducing nitroaromatic compounds Montedison S.p.A. (IT) 1984-01-04 EP claimed