SCHEMBL20025577

SCHEMBL20025577

C=NC(=C)c1ccccc1C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
ACHE P22303 2/20 0.39
TSHR P16473 1/20 0.39
HPGD P15428 1/20 0.38
ERCC5 P28715 1/20 0.37
FEN1 P39748 1/20 0.37
HTT P42858 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
PLK1 P53350 1/20 0.36
PLK2 Q9NYY3 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL17269703 0.76 MAOA (0.47) MAOAMAOBACHETSHRHPGD
SCHEMBL21765014 0.76 MAOA (0.39) MAOAMAOBACHETSHRHPGD
SCHEMBL2771852 0.75 MAOA (0.50) MAOAMAOBACHETSHRHPGD
SCHEMBL21440264 0.75 ERCC5 (0.41) MAOAMAOBTSHRHPGDERCC5
SCHEMBL21791009 0.74 ALDH1A1 (0.40) ACHETSHRHPGDKMT2A
SCHEMBL24080244 0.74 MEN1 (0.42) TSHRHPGDHTTNPC1SMN1; SMN2
SCHEMBL22343688 0.74 MAOA (0.42) MAOAMAOBACHETSHRHPGD
SCHEMBL18790247 0.74 MAOA (0.39) MAOAMAOBACHETSHRHPGD
SCHEMBL272167 0.73 MAOA (0.48) MAOAMAOBACHETSHRHPGD
SCHEMBL318284 0.73 MAOA (0.48) MAOAMAOBACHETSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365606-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-11-16 US disclosed
EP-3287441-B1 ACYLATED 4-AMINOPIPERIDINES AS INHIBITORS OF SERINE PALMITOYLTRANSFERASE TAKEDA PHARMACEUTICALS CO (JP) 2021-06-09 EP disclosed
WO-2018059263-A1 BISMUTH (III) COMPOUNDS AND METHODS THEREOF THE UNIVERSITY OF HONG KONG (CN) 2018-04-05 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 (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-20230365606-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OXER1, OPRD1, OXSR1 MAOA 857/4885MAOB 759/4885ACHE 1307/4885

“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.