SCHEMBL6662231

SCHEMBL6662231

C/C=C/C=C/c1ccccc1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.38
ALOX15 P16050 2/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 2/20 0.34
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32
ADRA2B P18089 1/20 0.32
PTGS1 P23219 1/20 0.32
TSHR P16473 3/20 0.32
PIK3CA P42336 1/20 0.32
MAOB P27338 1/20 0.32
NFE2L2 Q16236 2/20 0.31
TRPA1 O75762 1/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL6662242 1.00 CYP3A4 (0.38) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL14468404 1.00 CYP3A4 (0.38) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL24589393 1.00 CYP3A4 (0.38) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL11033480 0.89 CYP3A4 (0.47) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL11033484 0.89 CYP3A4 (0.47) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL7130266 0.84 CYP3A4 (0.43) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL417338 0.84 CYP3A4 (0.43) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL6241137 0.84 CYP3A4 (0.43) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL3765477 0.78 CYP3A4 (0.53) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL65321 0.78 CYP3A4 (0.53) CYP3A4ALOX15CASP1CASP7SMN1; SMN2

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
EP-0965890-B1 Method for forming color image KONISHIROKU PHOTO IND (JP) 2004-08-18 EP disclosed
US-6168892-B1 APPLYING A FLUORESCENT SUBSTANCE EXHIBITING EMISSION IN THE VISIBLE LIGHT WAVELENGTH REGION AS ADDITIVE COLOR MIXING TO A SUBTRACTIVE COLOR MIXTURE TO PERFORM COLOR CORRECTION KONICA CORPORATION (JP) 2001-01-02 US disclosed
EP-0965890-A1 Method for forming color image KONICA CORPORATION (JP) 1999-12-22 EP disclosed