SCHEMBL27520183

SCHEMBL27520183

c1ccc(-c2ccccc2N(c2ccccc2)c2ccc3ccccc3c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 2/20 0.35
GSTP1 P09211 1/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
INSR P06213 1/20 0.33
IGF1R P08069 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33

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
SCHEMBL4235561 0.95 PSMB5 (0.34) PSMB5GSTP1MAPTMEN1KMT2A
SCHEMBL14972789 0.94 ESR1 (0.36) GSTP1MAPTMEN1KMT2AALDH1A1
SCHEMBL17811611 0.92 PTGES (0.35) PSMB5GSTP1MAPTMEN1KMT2A
SCHEMBL17402625 0.91 CYP2A6 (0.42) PSMB5GSTP1MAPTMEN1KMT2A
SCHEMBL16385451 0.90 ESR1 (0.43) GSTP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL21168548 0.90 ESR1 (0.38) GSTP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL23225044 0.90 HSD17B1 (0.41) GSTP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL24918469 0.90 HSD17B1 (0.41) GSTP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL24814639 0.90 HSD17B1 (0.41) GSTP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL24918438 0.90 HSD17B1 (0.41) GSTP1MEN1KMT2ASMN1; SMN2ALDH1A1

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
CN-102484921-A Organic electroluminescent element KANEKA CORP 2012-05-30 CN disclosed
CN-1274033-C Organic electric luminescent device emitting white light with Improved efficiency and stability EASTMAN KODAK CO (US) 2006-09-06 CN disclosed
CN-1436027-A Organic electroluminescent device used with Mg cathode and with adhesion-promoting layer EASTMAN KODAK CO (US) 2003-08-13 CN disclosed
CN-1340865-A Organic electric luminescent device emitting white light with Improved efficiency and stability EASTMAN KODAK CO (US) 2002-03-20 CN disclosed