SCHEMBL24378167

SCHEMBL24378167

C1=CC=C(N2CCOCC2)CC=C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
KMT2A Q03164 5/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 4/20 0.36
HTT P42858 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPK1 P28482 3/20 0.36
KDM4E B2RXH2 2/20 0.36
TP53 P04637 2/20 0.36
USP2 O75604 2/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
STAT3 P40763 1/20 0.33
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
RAB9A P51151 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL28015655 0.79 MAPT (0.32) LMNAMAPTHTTALDH1A1KDM4E
SCHEMBL30425332 0.72 LMNA (0.36) LMNAKMT2AMAPTMEN1HTT
SCHEMBL10582630 0.69 LMNA (0.38) LMNAKMT2AMAPTMEN1HTT
SCHEMBL18052758 0.68 ALDH1A1 (0.38) KMT2AMAPTALDH1A1KDM4EGAA
SCHEMBL18052759 0.67 ADRB1 (0.41) ALDH1A1KDM4EUSP2SMN1; SMN2
SCHEMBL21088278 0.66 GAA (0.33) LMNAKMT2AMAPTMEN1ALDH1A1
SCHEMBL30885476 0.65 KMT2A (0.39) LMNAKMT2AMAPTMEN1HTT
SCHEMBL12662873 0.64 KDM4E (0.40) LMNAKMT2AMAPTMEN1HTT
SCHEMBL18052748 0.64 CHRNA7 (0.46) LMNAKMT2AMAPTMEN1HTT
SCHEMBL29868422 0.64 LMNA (0.36) LMNAKMT2AMAPTMEN1HTT

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
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed