SCHEMBL28490684

SCHEMBL28490684

Nc1c(Cl)ncnc1Nc1cccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.58
HPGD P15428 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
ALDH1A1 P00352 3/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
EPHX2 P34913 1/20 0.46
RAB9A P51151 3/20 0.44
MAPT P10636 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
HTT P42858 3/20 0.44
KMT2A Q03164 3/20 0.44
NPC1 O15118 2/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 2/20 0.44
MEN1 O00255 2/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL29740496 1.00 EGFR (0.58) EGFRHPGDSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL839219 0.81 TTBK1 (0.57) EGFRHPGDSMN1; SMN2ALDH1A1RAB9A
SCHEMBL839585 0.79 HTT (0.51) EGFRSMN1; SMN2RAB9AMAPTL3MBTL1
SCHEMBL16774914 0.79 PTK2 (0.54) EGFRHPGDSMN1; SMN2RAB9AMAPT
SCHEMBL6241529 0.77 EGFR (0.52) EGFRLMNATTBK1TTBK2KDM4C
SCHEMBL5357967 0.75 KMT2A (0.57) EGFRSMN1; SMN2ALDH1A1RAB9AMAPT
SCHEMBL28730906 0.75 EGFR (0.56) EGFRHPGDSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL1898192 0.74 EGFR (0.53) EGFRSMN1; SMN2ALDH1A1CYP1A2CYP2C9
SCHEMBL1096423 0.73 EGFR (0.54) EGFRHPGDSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL2243695 0.72 KDM4E (0.50) EGFRHPGDSMN1; SMN2ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118255767-A Compound ZDA, synthesis method thereof and application of compound ZDA in detection of glyphosate pesticide 江苏科技大学 2024-06-28 CN claimed
CN-117486883-A Purinyl fluorescent probe EDPH and application thereof in detection of content of hydrogen sulfide or Hela cell imaging 江苏科技大学 2024-02-02 CN claimed
CN-113980023-B Compound PHA, preparation method thereof and application thereof in detection of copper ions 江苏科技大学 2022-12-02 CN claimed
CN-113980023-A Compound PHA, preparation method thereof and application thereof in detection of copper ions 江苏科技大学 2022-01-28 CN claimed
CN-118255767-A Compound ZDA, synthesis method thereof and application of compound ZDA in detection of glyphosate pesticide 江苏科技大学 2024-06-28 CN disclosed
CN-117486883-A Purinyl fluorescent probe EDPH and application thereof in detection of content of hydrogen sulfide or Hela cell imaging 江苏科技大学 2024-02-02 CN disclosed
CN-114106018-B Metal ion detection fluorescent probe based on purine parent, and preparation method and application thereof 江苏科技大学 2023-07-25 CN disclosed
CN-113501822-B Purine-vanillin-based palladium and copper ion detection fluorescent probe and preparation method and application thereof 江苏科技大学 2023-03-21 CN disclosed
CN-113980021-B Preparation method and application of fluorescent probe for detecting bimetallic ions 江苏科技大学 2023-02-28 CN disclosed
CN-113980023-B Compound PHA, preparation method thereof and application thereof in detection of copper ions 江苏科技大学 2022-12-02 CN disclosed
CN-114773343-A Copper and zinc ion dual-detection fluorescent probe and preparation method thereof 江苏科技大学 2022-07-22 CN disclosed
CN-114106018-A Purine matrix-based metal ion detection fluorescent probe and preparation method and application thereof 江苏科技大学 2022-03-01 CN disclosed
CN-112321588-B Purine matrix-based zinc ion detection fluorescent probe and preparation method and application thereof 江苏科技大学 2021-12-07 CN disclosed
CN-113735858-A Purine matrix-based aluminum ion detection fluorescent probe and preparation method and application thereof 坛墨质检科技股份有限公司 2021-12-03 CN disclosed
CN-112110922-B Purine matrix-based aluminum ion detection fluorescent probe and preparation method and application thereof 江苏科技大学 2021-11-16 CN disclosed
CN-113512041-A Purine matrix-based zinc ion detection fluorescent probe and preparation method and application thereof 坛墨质检科技股份有限公司 2021-10-19 CN disclosed
CN-113501822-A Purine-vanillin-based palladium and copper ion detection fluorescent probe and preparation method and application thereof 江苏科技大学 2021-10-15 CN disclosed
CN-112321588-A Purine matrix-based zinc ion detection fluorescent probe and preparation method and application thereof 江苏科技大学 2021-02-05 CN disclosed
CN-112110922-A Purine matrix-based aluminum ion detection fluorescent probe and preparation method and application thereof 江苏科技大学 2020-12-22 CN disclosed
CN-112094270-A Purine parent-based cadmium ion detection fluorescent probe and preparation method and application thereof 江苏科技大学 2020-12-18 CN disclosed