SCHEMBL3706530

SCHEMBL3706530

C=CCNN(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
KCNH2 Q12809 2/20 0.36
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 2/20 0.34

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
SCHEMBL8017733 0.83 GAA (0.44) GAACYP1A2ALDH1A1LMNAHPGD
SCHEMBL4945883 0.79 GAA (0.42) GAACYP1A2ALDH1A1LMNAHPGD
SCHEMBL8602207 0.76 ALDH1A1 (0.37) GAACYP1A2ALDH1A1LMNAHPGD
SCHEMBL15518736 0.76 HTT (0.39) GAAALDH1A1LMNAL3MBTL1MEN1
SCHEMBL4070110 0.75 ALDH1A1 (0.42) GAACYP1A2ALDH1A1LMNAHPGD
SCHEMBL8602201 0.75 ALDH1A1 (0.36) GAACYP1A2ALDH1A1LMNAHPGD
SCHEMBL28711217 0.74 KDM4E (0.46) ALDH1A1
SCHEMBL28711216 0.74 KDM4E (0.46) ALDH1A1
SCHEMBL9015895 0.74 KMT2A (0.42) GAACYP1A2ALDH1A1LMNAHPGD
SCHEMBL17226156 0.72 CYP1A2 (0.38) GAACYP1A2MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2207868-A1 TRACTOR HYDRAULIC FLUID COMPOSITIONS AND PREPARATION THEREOF Chevron U.S.A., Inc. (US) 2010-07-21 EP claimed
WO-2009042396-A1 TRACTOR HYDRAULIC FLUID COMPOSITIONS AND PREPARATION THEREOF CHEVRON U.S.A. INC. (US) 2009-04-02 WO claimed
WO-2009032403-A1 HYDRAULIC FLUID COMPOSITIONS AND PREPARATION THEREOF CHEVRON U.S.A. INC. (US) 2009-03-12 WO claimed
JP-55143941-A None JP disclosed
JP-2005270910-A METHOD FOR REGENERATING REDUCTION CATALYST AND METHOD FOR PRODUCING (ALKYLAMINO)DIPHENYLAMINES SUMITOMO CHEMICAL CO LTD 2005-10-06 JP disclosed
JP-S55143941-A PREPARATION OF ALKYLAMINODIPHENYLAMINE SUMITOMO CHEM CO LTD 1980-11-10 JP disclosed