SCHEMBL5048009

SCHEMBL5048009

c1ccc2c(c1)Cc1c-2cccc1-c1cccc2cc3ccccc3cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.46
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
HTR7 P34969 4/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
HTR2B P41595 1/20 0.38
TSHR P16473 3/20 0.38
MAPK1 P28482 3/20 0.38
HSD17B10 Q99714 3/20 0.38
TP53 P04637 2/20 0.38
MEN1 O00255 1/20 0.38

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
Pyrene SCHEMBL28755896 0.94 ACHE (0.42) PNMTNPC1RAB9ACA1CA2
SCHEMBL31696778 0.89 PNMT (0.41) PNMTNPC1RAB9ACA1CA2
SCHEMBL4851750 0.86 PNMT (0.42) PNMTNPC1RAB9ACA1CA2
SCHEMBL30585506 0.86 PNMT (0.42) PNMTNPC1RAB9ACA1CA2
SCHEMBL27639839 0.85 PNMT (0.41) PNMTNPC1RAB9ACA1CA2
SCHEMBL31668825 0.84 PNMT (0.43) PNMTNPC1RAB9ACA1CA2
SCHEMBL6675750 0.83 PNMT (0.50) PNMTNPC1RAB9ACA1CA2
SCHEMBL29555007 0.83 PNMT (0.50) PNMTNPC1RAB9ACA1CA2
SCHEMBL29249276 0.82 ALDH1A1 (0.47) PNMTNPC1RAB9ACA1CA2
Fluorene SCHEMBL28444035 0.81 PNMT (0.49) PNMTNPC1RAB9ACA1CA2

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
CN-114014841-A Organic electroluminescent material based on phenylcarbonyl dibenzophenazine and application of organic electroluminescent material in OLED 华南理工大学 2022-02-08 CN disclosed
US-20080093986-A1 Ink For Forming Organic El Coating Film And Method For Production Thereof IDEMITSU KOSAN CO., LTD. (JP) 2008-04-24 US disclosed
EP-1850405-A1 INK FOR FORMING ORGANIC EL COATING FILM AND METHOD FOR PRODUCTION THEREOF IDEMITSU KOSAN CO., LTD. (JP) 2007-10-31 EP disclosed