SCHEMBL11380867

SCHEMBL11380867

CCOc1cc(N(CC)CC)ccc1C1(Nc2ccccc2-c2ccc(NC(C)=O)cc2)OC(=O)c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.37
MAPT P10636 5/20 0.37
ALDH1A1 P00352 6/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
PDK2 Q15119 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
POLB P06746 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
NOX1 Q9Y5S8 2/20 0.35
THRB P10828 1/20 0.35
GLA P06280 1/20 0.35
CYP3A4 P08684 1/20 0.35
GFER P55789 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL11367236 0.88 PGR (0.39) PGRMAPTALDH1A1L3MBTL1PDK2
SCHEMBL11380866 0.80 NOX1 (0.39) MAPTALDH1A1L3MBTL1PDK2LMNA
SCHEMBL11377390 0.80 CYP3A4 (0.44) MAPTALDH1A1L3MBTL1PDK2LMNA
SCHEMBL11236725 0.77 MAPT (0.39) PGRMAPTALDH1A1L3MBTL1LMNA
SCHEMBL11367714 0.77 MAPT (0.39) PGRMAPTALDH1A1L3MBTL1LMNA
SCHEMBL11461152 0.77 MEN1 (0.43) MAPTALDH1A1L3MBTL1PDK2LMNA
SCHEMBL11441222 0.76 RPS6KA2 (0.40) PGRMAPTALDH1A1L3MBTL1LMNA
SCHEMBL11440071 0.73 RPS6KA2 (0.37) MAPTALDH1A1L3MBTL1PDK2LMNA
SCHEMBL11240846 0.73 MAPT (0.36) MAPTALDH1A1LMNAKMT2APOLB
SCHEMBL9482502 0.73 SMN1; SMN2 (0.42) MAPTALDH1A1L3MBTL1PDK2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4255577-A Process and intermediates for preparing 3-[4-(disubstituted-amino)phenyl] or STERLING DRUG INC. (US) 1981-03-10 US disclosed
US-4200313-A Carbonless duplicating systems STERLING DRUG INC. (US) 1980-04-29 US disclosed
US-4187223-A 3-[4-(Disubstituted-amino)phenyl]-3-(diphenylamino)phthalides STERLING DRUG INC. (US) 1980-02-05 US disclosed