SCHEMBL5435508

SCHEMBL5435508

CN(N)c1cnc2ccccc2n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.49
▸ KDM4E B2RXH2 6/20 0.49
▸ NPC1 O15118 5/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ MAPT P10636 4/20 0.49
▸ L3MBTL1 Q9Y468 3/20 0.49
▸ GAA P10253 4/20 0.47
▸ ALDH1A1 P00352 5/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ PDE10A Q9Y233 1/20 0.44
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ HTT P42858 6/20 0.43
▸ NCF1 P14598 1/20 0.42
▸ HPGD P15428 3/20 0.42
▸ ATM Q13315 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ HTR3A P46098 1/20 0.42

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
SCHEMBL7048629 0.83 NCF1 (0.55) RAB9AKDM4ENPC1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL28590788 0.82 NCF1 (0.53) RAB9AKDM4ENPC1SMN1; SMN2MAPT
SCHEMBL6034068 0.80 HTT (0.50) RAB9AKDM4ENPC1SMN1; SMN2MAPT
SCHEMBL13557874 0.77 RAB9A (0.50) RAB9AKDM4ENPC1SMN1; SMN2MAPT
SCHEMBL13557867 0.77 KDM4E (0.47) RAB9AKDM4ENPC1SMN1; SMN2MAPT
SCHEMBL31314983 0.77 SMN1; SMN2 (0.39) RAB9AKDM4ENPC1SMN1; SMN2MAPT
SCHEMBL28585105 0.74 PDE10A (0.47) RAB9AKDM4ENPC1SMN1; SMN2MAPT
SCHEMBL13557884 0.74 RAB9A (0.48) RAB9AKDM4ENPC1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL28608866 0.73 PDE10A (0.46) RAB9AKDM4ENPC1SMN1; SMN2MAPT
SCHEMBL28679814 0.73 KDM4E (0.45) RAB9AKDM4ENPC1SMN1; SMN2MAPT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12006463-B2 Polymerizable liquid crystal having a quinoxaline-hydrazone core Rolic Technologies AG (CH) 2024-06-11 — — US disclosed
CN-114026074-B Novel polymerizable liquid crystal having quinoxaline-hydrazone nucleus 罗利克技术有限公司 2024-02-09 — — CN disclosed
EP-3990568-B1 NEW POLYMERIZABLE LIQUID CRYSTAL HAVING A QUINOXALINE-HYDRAZONE CORE ROLIC TECH AG (CH) 2023-11-15 — — EP disclosed
US-20220251450-A1 NEW POLYMERIZABLE LIQUID CRYSTAL HAVING A QUINOXALINE-HYDRAZONE CORE Rolic Technologies AG (CH) 2022-08-11 — — US disclosed
EP-4022008-A1 COMPOSITIONS OF POLYMERIZABLE LIQUID CRYSTALS Rolic Technologies AG (CH) 2022-07-06 — — EP disclosed
CN-114026074-A Novel polymerizable liquid crystals with quinoxaline-hydrazone cores 罗利克技术有限公司 2022-02-08 — — CN disclosed
US-20070238700-A1 N-PHENYL-1,1,1-TRIFLUOROMETHANESULFONAMIDE HYDRAZONE DERIVATIVE COMPOUNDS AND THEIR USAGE IN CONTROLLING PARASITES SCHERING-PLOUGH LTD. (CH) 2007-10-11 — — 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 (3 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-12006463-B2 Polymerizable liquid crystal having a quinoxaline-hydrazone core AQP1, AQP4, HCN1 RAB9A 1201/4885KDM4E 2894/4885NPC1 3665/4885
US-20070238700-A1 N-PHENYL-1,1,1-TRIFLUOROMETHANESULFONAMIDE HYDRAZONE DERIVATIVE COMPOUNDS AND THEIR USAGE IN CONTROLLING PARASITES NAT1, NGLY1, ELANE RAB9A 831/4885KDM4E 1150/4885NPC1 313/4885
US-20220251450-A1 NEW POLYMERIZABLE LIQUID CRYSTAL HAVING A QUINOXALINE-HYDRAZONE CORE AQP1, AQP4, HCN1 RAB9A 1175/4885KDM4E 2985/4885NPC1 3829/4885

“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.

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