SCHEMBL15319933

SCHEMBL15319933

Cc1nc(-c2ccccc2)n(C2CCCCC2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.55
CNR1 P21554 2/20 0.46
KCNJ3 P48549 9/20 0.42
KCNJ6 P48051 8/20 0.42
KCNJ5 P48544 6/20 0.42
GAA P10253 1/20 0.41
ALOX15 P16050 1/20 0.41
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 1/20 0.40
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CNR2 P34972 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL18592035 0.90 HPGD (0.49) HPGDCNR1KCNJ3KCNJ6KCNJ5
SCHEMBL15322321 0.78 KDM4E (0.38) HPGDCNR1GAAALDH1A1KDM4E
SCHEMBL27217007 0.73 HPGD (0.40) HPGDCNR1RAB9AKMT2AHTR2A
SCHEMBL18659579 0.73 ALDH1A1 (0.42) HPGDGAAALOX15ALDH1A1KDM4E
SCHEMBL5288319 0.73 HPGD (0.54) HPGDCNR1KCNJ3KCNJ6KCNJ5
SCHEMBL27940238 0.73 IDO1 (0.38) HPGDKCNJ3KCNJ6LMNAKDM4E
SCHEMBL10635534 0.72 DRD4 (0.63) HPGDALDH1A1RAB9ALMNAKDM4E
SCHEMBL10631275 0.70 DRD4 (0.65) HPGDALOX15ALDH1A1RAB9ALMNA
SCHEMBL5288314 0.70 CNR1 (0.52) HPGDCNR1KCNJ3KCNJ6KCNJ5
SCHEMBL18655421 0.68 ALDH1A1 (0.39) HPGDGAAALDH1A1KDM4EHSD17B10

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-9593085-B2 Blue luminescent compounds LG CHEM, LTD. (KR) 2017-03-14 US disclosed
EP-2834249-A1 BLUE LUMINESCENT COMPOUNDS E. I. Du Pont de Nemours and Company (US) 2015-02-11 EP disclosed
CN-104203960-A Blue luminescent compounds DU PONT 2014-12-10 CN disclosed
WO-2013151989-A1 BLUE LUMINESCENT COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-10-10 WO disclosed