SCHEMBL22965263

SCHEMBL22965263

Cc1nc2ccccc2n1CCC(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.65
KDM4E B2RXH2 1/20 0.65
KMT2A Q03164 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.63
APAF1 O14727 1/20 0.61
SMN1; SMN2 Q16637 3/20 0.59
RAB9A P51151 1/20 0.59
TNF P01375 1/20 0.58
USP2 O75604 1/20 0.58
POLB P06746 1/20 0.58
ALDH1A1 P00352 1/20 0.57
HTT P42858 2/20 0.57
TSHR P16473 2/20 0.57
TP53 P04637 1/20 0.57
HDAC6 Q9UBN7 1/20 0.56
PKM P14618 1/20 0.55
GSK3B P49841 1/20 0.54
FABP3 P05413 1/20 0.54
FABP4 P15090 1/20 0.54
FABP5 Q01469 1/20 0.54

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
SCHEMBL28516010 0.91 LMNA (0.62) LMNAKDM4EKMT2AL3MBTL1APAF1
SCHEMBL22965215 0.90 LMNA (0.60) LMNAKDM4EKMT2AL3MBTL1APAF1
SCHEMBL540852 0.88 LMNA (0.59) LMNAKDM4EKMT2AL3MBTL1APAF1
SCHEMBL3587930 0.84 KDM4E (0.69) LMNAKDM4EKMT2AAPAF1SMN1; SMN2
SCHEMBL14616345 0.84 ALDH1A1 (0.58) LMNAKDM4EAPAF1SMN1; SMN2TNF
SCHEMBL9694037 0.83 KDM4E (0.73) LMNAKDM4EKMT2AL3MBTL1SMN1; SMN2
SCHEMBL6446137 0.83 LMNA (0.69) LMNAAPAF1SMN1; SMN2RAB9ATNF
SCHEMBL22965266 0.82 KDM4E (0.59) LMNAKDM4EKMT2AAPAF1SMN1; SMN2
SCHEMBL14575429 0.82 TSHR (0.62) LMNAKDM4EAPAF1SMN1; SMN2HTT
SCHEMBL22639681 0.82 KMT2A (0.74) LMNAKDM4EKMT2AL3MBTL1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021023796-A1 COMPOSITIONS FOR TRANSFECTING A NUCLEIC ACID MOLECULE INTO A CELL COMPRISING HETEROCYCLIC COMPOUNDS GRAFTED TO A CATIONIC POLYMER, AND THEIR APPLICATIONS POLYPLUS TRANSFECTION (FR) 2021-02-11 WO disclosed