SCHEMBL11220728

SCHEMBL11220728

CCN(CC)c1ccc(C=O)cc1.c1ccc(N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.78
ALDH1A3 P47895 2/20 0.78
ALDH3A1 P30838 1/20 0.78
ESRRG P62508 1/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
KDM4E B2RXH2 3/20 0.49
GAA P10253 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
NOX1 Q9Y5S8 1/20 0.49
CNR2 P34972 1/20 0.49
TSHR P16473 2/20 0.48
CYP2A6 P11509 2/20 0.48
CYP2A13 Q16696 1/20 0.48
MAPT P10636 6/20 0.48
LMNA P02545 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL11937051 0.92 ALDH1A1 (0.91) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
Biphenyl SCHEMBL1200005 0.89 ALDH1A1 (0.78) ALDH1A1ALDH1A3ALDH3A1ESRRGMEN1
SCHEMBL195135 0.88 ALDH1A1 (1.00) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL5733313 0.88 ALDH1A1 (1.00) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL181026 0.88 ALDH1A1 (0.59) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL28032989 0.88 ALDH1A1 (0.59) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL851178 0.88 ALDH1A1 (0.59) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL2199745 0.88 ALDH1A1 (0.59) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL13649928 0.88 ALDH1A1 (0.59) ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A
SCHEMBL9150780 0.88 ALDH1A1 (0.70) ALDH1A1ALDH1A3ALDH3A1ESRRGMEN1

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-4322487-A Composite electrically photosensitive particles for electrophoretic migration imaging process EASTMAN KODAK COMPANY (US) 1982-03-30 US disclosed