SCHEMBL29862298

SCHEMBL29862298

Cc1cccc2c(N(C)C)ccc(C)c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 1/20 0.47
CHEK1 O14757 1/20 0.45
NEK2 P51955 1/20 0.45
LIMK1 P53667 1/20 0.45
DYRK1A Q13627 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45
CYP1A2 P05177 2/20 0.44
CYP2A6 P11509 2/20 0.44
EP300 Q09472 1/20 0.44
KAT2B Q92831 1/20 0.44
KAT8 Q9H7Z6 1/20 0.44
KDM4E B2RXH2 4/20 0.43
GAA P10253 3/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.43
USP2 O75604 1/20 0.42
TSHR P16473 1/20 0.42
CA2 P00918 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
SCHEMBL12566503 0.79 MEN1 (0.52) MEN1KMT2APOLBCHEK1NEK2
SCHEMBL1755244 0.77 CYP1A2 (0.62) MEN1KMT2APOLBCHEK1NEK2
SCHEMBL469267 0.77 CYP1A2 (0.62) KMT2ACHEK1NEK2LIMK1DYRK1A
SCHEMBL29862285 0.77 CYP1A2 (0.62) MEN1KMT2APOLBCHEK1NEK2
SCHEMBL29862158 0.77 CYP1A2 (0.62) KMT2ACHEK1NEK2LIMK1DYRK1A
SCHEMBL29378790 0.76 CYP1A2 (0.67) MEN1KMT2ACYP1A2CYP2A6KDM4E
SCHEMBL598068 0.76 CYP1A2 (0.67) MEN1KMT2ACYP1A2CYP2A6KDM4E
SCHEMBL8990307 0.73 CHEK1 (0.73) MEN1KMT2APOLBCHEK1NEK2
SCHEMBL8720110 0.73 CHEK1 (0.65) MEN1KMT2APOLBCHEK1NEK2
SCHEMBL29919884 0.73 CHEK1 (0.73) MEN1KMT2APOLBCHEK1NEK2

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
WO-2025078298-A1 METHODS FOR THE SAMPLING AND AUTHENTICATION OF MARKERS IN PRESSURIZED LIQUIFIED HYDROCARBON PRODUCTS SICPA HOLDING SA (CH) 2025-04-17 WO disclosed
EP-4069807-A1 METHOD FOR DETERMINING AUTHENTICITY AND ADULTERATION OF MARKED PETROLEUM HYDROCARBONS Sicpa Holding SA (CH) 2022-10-12 EP disclosed
EP-4069806-A1 METHOD OF MARKING A PETROLEUM HYDROCARBON Sicpa Holding SA (CH) 2022-10-12 EP disclosed