SCHEMBL11370697

SCHEMBL11370697

CN(C)c1ccc(N(c2ccc(N(C)C)cc2)C2(c3ccc(N(C)C)cc3)OC(=O)c3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
TDP1 Q9NUW8 6/20 0.50
CYP3A4 P08684 4/20 0.50
HPGD P15428 4/20 0.50
HSD17B10 Q99714 2/20 0.50
HIF1A Q16665 1/20 0.50
MEN1 O00255 7/20 0.46
KMT2A Q03164 7/20 0.46
CFTR P13569 1/20 0.41
GOPC Q9HD26 1/20 0.41
MAPT P10636 5/20 0.41
LMNA P02545 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
POLB P06746 2/20 0.41
TP53 P04637 2/20 0.41
TSHR P16473 2/20 0.41
ESR1 P03372 1/20 0.41
TYMS P04818 1/20 0.41
ALOX15 P16050 1/20 0.41
ESR2 Q92731 1/20 0.41

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
SCHEMBL11441974 0.97 TDP1 (0.48) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL11377272 0.97 TDP1 (0.48) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL11456350 0.91 TDP1 (0.50) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL29139759 0.91 ALDH1A1 (0.52) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL11374410 0.88 NPSR1 (0.47) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL11374917 0.87 ALDH1A1 (0.68) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL11374518 0.87 TDP1 (0.45) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL11375868 0.86 ALDH1A1 (0.63) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL11448925 0.86 ALDH1A1 (0.63) ALDH1A1TDP1CYP3A4HPGDHSD17B10
SCHEMBL11365552 0.86 ATM (0.42) ALDH1A1TDP1CYP3A4HPGDHSD17B10

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 4 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
US-4168378-A THERMOGRAPHY, LEUCO DYES STERLING DRUG INC. (US) 1979-09-18 US disclosed