SCHEMBL11242874

SCHEMBL11242874

CC(=O)OC(C)(C)/C(=N/O)n1cncn1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 3/20 0.36
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
MAPT P10636 2/20 0.35
PKM P14618 2/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MITF O75030 1/20 0.35
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
ATM Q13315 2/20 0.34
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
PDE4B Q07343 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL11242876 1.00 ALDH1A1 (0.36) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL11238692 0.81 MEN1 (0.34) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL11238687 0.81 MEN1 (0.34) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL11241820 0.78 FAAH (0.38) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL11342532 0.78 FAAH (0.38) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL11241459 0.77 ELANE (0.36) PDE4B
SCHEMBL11241458 0.77 ELANE (0.36) PDE4B
SCHEMBL11238546 0.77 RAB9A (0.39) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL11238548 0.77 RAB9A (0.39) ALDH1A1MEN1KMT2ALMNARAB9A
SCHEMBL11234681 0.76 L3MBTL1 (0.33) ALDH1A1LMNA

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
US-4344953-A INSECTICIDES, NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DE) 1982-08-17 US disclosed