SCHEMBL82347

SCHEMBL82347

Cc1ccc(-n2cncn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.60
KDM4E B2RXH2 2/20 0.60
ALDH1A1 P00352 1/20 0.60
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
CYP2A6 P11509 1/20 0.50
HSP90AA1 P07900 1/20 0.48
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48
FBP1 P09467 1/20 0.47
NOTUM Q6P988 2/20 0.44
ESR1 P03372 1/20 0.40
CYP19A1 P11511 1/20 0.40
ESR2 Q92731 1/20 0.40
FLT3 P36888 1/20 0.40
MAPK10 P53779 1/20 0.39
CYP11B2 P19099 1/20 0.39
BRS3 P32247 1/20 0.39

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
SCHEMBL28838269 0.82 SMN1; SMN2 (0.44) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL1620488 0.78 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL4573337 0.78 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL16478505 0.78 NOTUM (0.48) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL4343120 0.78 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL676377 0.78 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL9363173 0.78 KDM4E (0.60) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL118713 0.78 KDM4E (0.60) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL5663652 0.78 KDM4E (0.60) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL5535834 0.78 SMN1; SMN2 (0.66) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105019013-A Blue-light emitting monocrystalline material preparation method UNIV TAIYUAN TECHNOLOGY 2015-11-04 CN claimed
CN-103664811-B (1H-1,2,4-triazol-1-yl) aryl compound and preparation method thereof IHARA CHEMICAL IND CO. (JP) 2015-09-16 CN claimed
EP-2226317-B1 ARYL (1H-1,2,4-TRIAZOL-1-YL) COMPOUND, AND PROCESS FOR PRODUCTION THEREOF IHARA CHEMICAL IND CO (JP) 2015-08-12 EP claimed
US-8648207-B2 Aryl (1H-1,2,4-triazol-1-yl) compound, and process for production thereof IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2014-02-11 US claimed
US-20130023666-A1 ARYL (1H-1,2,4-TRIAZOL-1-YL) COMPOUND, AND PROCESS FOR PRODUCTION THEREOF IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2013-01-24 US claimed
US-20100256386-A1 ARYL (1H-1,2,4-TRIAZOL-1-YL) COMPOUND AND PROCESS FOR PRODUCTION THEREOF IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2010-10-07 US claimed
EP-2226317-A1 ARYL (1H-1,2,4-TRIAZOL-1-YL) COMPOUND, AND PROCESS FOR PRODUCTION THEREOF IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2010-09-08 EP claimed
EP-3483144-B1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD CONTROLLING AGENT CONTAINING SAME SUMITOMO CHEMICAL CO (JP) 2023-10-11 EP disclosed
US-11779018-B2 Heterocyclic compound and arthropod pest control composition containing same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-10 US disclosed
US-11779018-B2 Heterocyclic compound and arthropod pest control composition containing same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-10 US disclosed
EP-4219465-A2 PRMT5 INHIBITORS AND USES THEREOF Epizyme Inc (US) 2023-08-02 EP disclosed
US-11690378-B2 Substituted pyridines as noxious arthropod control agents SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-07-04 US disclosed
US-11690378-B2 Substituted pyridines as noxious arthropod control agents SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-07-04 US disclosed
US-20030220272-A1 6-O-acyl ketolide antibacterials ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-11-27 US disclosed
US-6613747-B2 Erythromycins to treat community-acquired pneumonia and upper and lower respiratory tract, skin and soft tissue, hospital-acquired lung, bone and joint infections; Staphyloccus; Enterococcus; Moraxella; Hemophilus; antibiotic resistance ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-09-02 US disclosed
WO-2003007954-A2 SULFONYL ARYL HYDROXAMATES AND THEIR USE AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-01-30 WO disclosed
US-6472372-B1 6-O-Carbamoyl ketolide antibacterials ORTHO-MCNEIL PHARMACEUTICALS, INC. 2002-10-29 US disclosed
US-20020115620-A1 6-0-carbamoyl ketolide antibacterials ORTHO-MCNEIL PHARMACEUTICAL, INC. 2002-08-22 US disclosed
EP-1003505-A1 HETEROCYCLIC VINYLETHERS AGAINST NEUROLOGICAL DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2000-05-31 EP disclosed
WO-1999008678-A1 HETEROCYCLIC VINYLETHERS AGAINST NEUROLOGICAL DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 1999-02-25 WO 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 (6 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-20100256386-A1 ARYL (1H-1,2,4-TRIAZOL-1-YL) COMPOUND AND PROCESS FOR PRODUCTION THEREOF CYP1A1, CYP2S1, NAT1 SMN1; SMN2 4288/4885KDM4E 2741/4885ALDH1A1 217/4885
US-11690378-B2 Substituted pyridines as noxious arthropod control agents COX6C, C5, COX6B1 SMN1; SMN2 2016/4885KDM4E 1244/4885ALDH1A1 1417/4885
US-20030220272-A1 6-O-acyl ketolide antibacterials Q6ZSR9, ACSL6, RPS4Y1 SMN1; SMN2 4073/4885KDM4E 18/4885ALDH1A1 2109/4885
US-11779018-B2 Heterocyclic compound and arthropod pest control composition containing same C5, PRXL2A, NOX3 SMN1; SMN2 2926/4885KDM4E 869/4885ALDH1A1 2765/4885
US-20130023666-A1 ARYL (1H-1,2,4-TRIAZOL-1-YL) COMPOUND, AND PROCESS FOR PRODUCTION THEREOF CYP1B1, CYP1A1, AOC3 SMN1; SMN2 4111/4885KDM4E 3697/4885ALDH1A1 99/4885
US-20020115620-A1 6-0-carbamoyl ketolide antibacterials Q6ZSR9, HK1, KDM4E SMN1; SMN2 4281/4885KDM4E 3/4885ALDH1A1 3629/4885

“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.