SCHEMBL4201803

SCHEMBL4201803

CCCCCOc1ncncn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.41
NR5A1 Q13285 1/20 0.39
LTA4H P09960 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
NPC1 O15118 2/20 0.37
LMNA P02545 2/20 0.37
SOAT1 P35610 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 2/20 0.35
PLA2G2A P14555 1/20 0.35
TP53 P04637 1/20 0.35
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL3662611 0.98 NR5A1 (0.42) CYP2D6NR5A1LTA4HCYP3A4NPC1
SCHEMBL28717776 0.98 NR5A1 (0.42) CYP2D6NR5A1LTA4HCYP3A4NPC1
SCHEMBL4924806 0.93 CYP2D6 (0.46) CYP2D6NR5A1LTA4HCYP3A4CYP1A2
SCHEMBL4919744 0.86 CYP2D6 (0.35) CYP2D6LTA4HCYP3A4CYP1A2CYP2C9
SCHEMBL28703161 0.83 CYP2D6 (0.37) CYP2D6NR5A1LTA4HCYP3A4CYP1A2
SCHEMBL4541652 0.79 LTA4H (0.44) CYP2D6NR5A1LTA4HCYP3A4CYP1A2
SCHEMBL899058 0.78 NR5A1 (0.43) NR5A1LTA4HSOAT1TSHRPLA2G2A
SCHEMBL5187242 0.77
SCHEMBL9683872 0.77 NR5A1 (0.44) CYP2D6NR5A1LTA4HCYP1A2CYP2C9
SCHEMBL9851145 0.77 NR5A1 (0.44) CYP2D6NR5A1LTA4HCYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0945477-B1 Cyanate ester based thermoset compositions GEN ELECTRIC (US) 2004-09-22 EP claimed
EP-0949251-B1 Diresorcinyltriazines as sunscreen agents CIBA HOLDING INC (CH) 2009-04-01 EP disclosed
JP-2008019229-A SYNTHESIS OF 2-ALKOXY-4,6-BIS[4-(5-CHLORO-2H-BENZOTRIAZOL-2-YL)-3-HYDROXYPHENOXY]-1,3,5-TRIAZINE AND 2-ARYLOXY-4,6-BIS[4-(5-CHLORO-2H-BENZOTRIAZOL-2-YL)-3-HYDROXYPHENOXY]-1,3,5-TRIAZINE, AND UTILIZATION THEREOF AS ULTRAVIOLET ABSORBER SHIPRO KASEI KAISHA LTD 2008-01-31 JP disclosed
WO-2007137190-A2 FUNCTIONALLY DIVERSE MACROMOLECULES AND THEIR SYNTHESIS THE TEXAS A & M UNIVERSITY SYSTEM (US) 2007-11-29 WO disclosed
US-20070098676-A1 FUNCTIONALLY DIVERSE MACROMOLECULES AND THEIR SYNTHESIS THE TEXAS A&M UNIVERSITY SYSTEM 2007-05-03 US disclosed
CN-1168722-C Diresorcinyl-alkoxy-and-aryloxy-s-triazines �������⻯ѧƷ�ع����޹�˾ 2004-09-29 CN disclosed
US-6403229-B2 CURABLE COMPOSITIONS OF A CYANATE ESTER AND A CYANATE ESTER PREPOLYMER, A CYANATE ESTER-FREE ARYLOXYTRIAZINE, AND A CURING CATALYST USED IN CIRCUIT BOARDS, STRUCTURAL COMPOSITES, ENCAPSULATING RESINS, ETC... GENERAL ELECTRIC COMPANY 2002-06-11 US disclosed
US-6245841-B1 BLEND CONTAINING FLAME RETARDER AND CURING AGENT GENERAL ELECTRIC COMPANY 2001-06-12 US disclosed
US-6194495-B1 CURBLE COMPOSITION WITH ARYLOXYTRIAZINE GENERAL ELECTRIC COMPANY 2001-02-27 US disclosed
CN-1232027-A Diresorcinyl-alkoxy-and-aryloxy-s-triazines CIBA SC HOLDING AG (CH) 1999-10-20 CN disclosed
US-4748236-A Azo dyestuffs having sulpho ortho to azo bridge and containing two triazine reactive groups BAYER AKTIENGESELLSCHAFT (DE) 1988-05-31 US disclosed
EP-0155580-B1 MONOAZO DYESTUFFS, PROCESS FOR THEIR PREPARATION AND THEIR USE CASSELLA Aktiengesellschaft (DE) 1987-01-28 EP disclosed
EP-0108924-A1 Heavy metal-containing formazane dyestuffs, methods for their preparation and their use in the dyeing and printing of fibre materials BAYER AG (DE) 1984-05-23 EP disclosed
EP-0021372-B1 COPPER COMPLEXES OF DISAZO REACTIVE DYESTUFFS BAYER AG (DE) 1982-07-07 EP disclosed
EP-0043411-A2 Reactive disazo dyestuffs, process for their preparation and their use in dyeing and printing materials containing nitrogen and/or hydroxyle groups BAYER AG (DE) 1982-01-13 EP disclosed
US-4299764-A Azo reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1981-11-10 US disclosed
US-4281124-A Reactive quaternary compounds, their preparation and their use for increasing the affinity of anionic dyestuffs for fibres which contain nitrogen or hydroxyl groups BAYER AKTIENGESELLSCHAFT (DE) 1981-07-28 US disclosed
EP-0013936-A1 Reactive azo dyestuffs, their preparation and their use in dyeing materials containing hydroxyl groups and amide groups BAYER AG (DE) 1980-08-06 EP disclosed
US-4136092-A SUBSTITUTED DI- OR TRIAMINO-S-TRIAZINES THIOKOL CORPORATION (US) 1979-01-23 US disclosed
US-3957751-A WATER-SOLUBLE REACTIVE DYESTUFFS OF THE MONOAZO SERIES CONTAINING AN ACTIVE METHYLENE COUPLING COMPONENT HOECHST AKTIENGESELLSCHAFT (DT) 1976-05-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070098676-A1 FUNCTIONALLY DIVERSE MACROMOLECULES AND THEIR SYNTHESIS ECPAS, PCNA, MRPS22 CYP2D6 3671/4885NR5A1 4761/4885LTA4H 2900/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.