SCHEMBL22796308

SCHEMBL22796308

O=C(O)C1CCN(c2nc3ccc(C(F)(F)F)cc3n3cccc23)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.57
KDM4E B2RXH2 2/20 0.57
ADRB2 P07550 1/20 0.57
ADRA2A P08913 1/20 0.57
MEN1 O00255 1/20 0.57
GMNN O75496 1/20 0.57
MAPK1 P28482 1/20 0.57
PMP22 Q01453 1/20 0.57
KMT2A Q03164 1/20 0.57
RORC P51449 4/20 0.56
TP53 P04637 7/20 0.55
HTR2C P28335 3/20 0.55
HTR1D P28221 2/20 0.55
HTR1A P08908 2/20 0.55
HTR3E A5X5Y0 1/20 0.55
HTR3B O95264 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
TSHR P16473 1/20 0.55

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
SCHEMBL22796309 0.88 LMNA (0.52) LMNAKDM4EADRB2ADRA2AMEN1
SCHEMBL22796411 0.86 TP53 (0.52) LMNAKDM4EADRB2ADRA2AMEN1
SCHEMBL22796306 0.78 HTR3E (0.57) LMNAKDM4EADRB2ADRA2AMEN1
SCHEMBL22796307 0.77 TP53 (0.51) LMNAKDM4EADRB2ADRA2AMEN1
SCHEMBL22796772 0.77 HTR2C (0.60) LMNAKDM4EADRB2ADRA2AMEN1
SCHEMBL22796776 0.73 HTR2C (0.56) LMNAKDM4EADRB2ADRA2AMEN1
Maleic Acid SCHEMBL29931110 0.73 KDM4E (1.00) LMNAKDM4EADRB2ADRA2AMEN1
Maleic Acid SCHEMBL30011289 0.73 KDM4E (1.00) LMNAKDM4EADRB2ADRA2AMEN1
Maleic Acid SCHEMBL7746196 0.73 KDM4E (1.00) LMNAKDM4EADRB2ADRA2AMEN1
Fumaric Acid SCHEMBL7746202 0.73 KDM4E (1.00) LMNAKDM4EADRB2ADRA2AMEN1

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-2020252195-A1 TELOMERASE REVERSE TRANSCRIPTASE DEGRADERS AND METHODS OF USE THEREOF THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2020-12-17 WO disclosed