SCHEMBL30797249

SCHEMBL30797249

O=C(NCCCl)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.64
MEN1 O00255 5/20 0.64
KMT2A Q03164 5/20 0.64
HTT P42858 3/20 0.64
RAB9A P51151 1/20 0.64
ALDH1A1 P00352 1/20 0.62
CNR1 P21554 1/20 0.58
KDR P35968 1/20 0.58
GOT1 P17174 1/20 0.58
NPSR1 Q6W5P4 2/20 0.56
XBP1 P17861 2/20 0.56
GAA P10253 2/20 0.56
LMNA P02545 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
KDM4E B2RXH2 1/20 0.54
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
TP53 P04637 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
SCHEMBL13737287 1.00 MAPT (0.64) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL14685427 0.87 MAPT (0.66) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL12989341 0.86 LMNA (0.71) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL5759619 0.83 MEN1 (0.61) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL30101230 0.83 KMT2A (0.90) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL5597699 0.83 KMT2A (0.90) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL3429585 0.82 MAPT (0.68) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL28406980 0.82 MEN1 (0.73) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL3865228 0.82 KMT2A (0.59) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL136432 0.82 MEN1 (0.72) MAPTMEN1KMT2AHTTCNR1

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-2023244817-A1 SUBSTITUTED PIPERIDINES AS CK1A DEGRADERS MONTE ROSA THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed