SCHEMBL9380274

SCHEMBL9380274

CC1(C)CC(Nc2ccccc2)CC(C)(C)N1

nearest known ligand 0.87

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.87
ALDH1A1 P00352 3/20 0.87
LMNA P02545 2/20 0.87
MEN1 O00255 1/20 0.87
MAPT P10636 1/20 0.87
PKM P14618 1/20 0.87
ALOX15 P16050 1/20 0.87
ALOX12 P18054 1/20 0.87
RAD52 P43351 1/20 0.87
GFER P55789 1/20 0.87
L3MBTL1 Q9Y468 1/20 0.87
KDM1A O60341 1/20 0.54
POLB P06746 1/20 0.50
EZH2 Q15910 3/20 0.49
GAA P10253 3/20 0.48
HTT P42858 1/20 0.48
KDM4E B2RXH2 3/20 0.47
TSHR P16473 2/20 0.46
KCNH2 Q12809 2/20 0.45

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
SCHEMBL8738952 0.93 ALDH1A1 (1.00) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL10780921 0.90 ALDH1A1 (0.77) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL9372093 0.81 KMT2A (0.61) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL20357747 0.81 ALDH1A1 (0.66) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL7793247 0.80 KMT2A (0.59) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL3601057 0.80 ALDH1A1 (0.59) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL19780825 0.79 ALDH1A1 (0.77) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL28464888 0.78 ALDH1A1 (0.60) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL19782763 0.78 ALDH1A1 (0.74) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL2289255 0.77 GAA (0.62) KMT2AALDH1A1LMNAMEN1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0355645-B1 Cyclic amidines and process for their preparation BAYER AG (DE) 1994-04-27 EP disclosed
EP-0355645-A2 Cyclic amidines and process for their preparation BAYER AG (DE) 1990-02-28 EP disclosed