SCHEMBL11214822

SCHEMBL11214822

CC(NC1CC(C)(C)NC(C)(C)C1)NC1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.44
TSHR P16473 2/20 0.41
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 2/20 0.38
PKM P14618 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
RAD52 P43351 1/20 0.38
GFER P55789 1/20 0.38
POLB P06746 2/20 0.38
GAA P10253 3/20 0.37
KDM1A O60341 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL9323450 0.86 RECQL (0.44) RECQLTSHRKMT2ALMNAMAPT
SCHEMBL12637270 0.80 GAA (0.38) RECQLTSHRKMT2ALMNAMAPT
SCHEMBL16678900 0.80 RECQL (0.38) RECQLTSHRKMT2AL3MBTL1MEN1
SCHEMBL17947394 0.79 RECQL (0.39) RECQLTSHRKMT2ALMNAMAPT
SCHEMBL11085648 0.79 RECQL (0.39) RECQLTSHRKMT2ALMNAMAPT
SCHEMBL10743325 0.77 GAA (0.43) RECQLTSHRKMT2AALDH1A1L3MBTL1
SCHEMBL8430842 0.77 TSHR (0.43) RECQLTSHRKMT2AL3MBTL1MEN1
SCHEMBL2901200 0.76 RECQL (0.52) RECQLTSHRKMT2ALMNAMAPT
SCHEMBL11139939 0.76 GAA (0.41) RECQLTSHRKMT2ALMNAMAPT
SCHEMBL10444750 0.76 POLB (0.45) RECQLTSHRKMT2ALMNAMAPT

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-4322531-A Diazaphospholanes and diazaphosphorinanes CIBA-GEIGY CORPORATION (US) 1982-03-30 US disclosed