SCHEMBL19986058

SCHEMBL19986058

c1ccc2c(c1)oc1c2c2c3ccccc3c3ccccc3c2c2c3ccccc3n(-c3ccc4c5ccccc5c5ccccc5c4c3)c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 6/20 0.34
ALDH1A1 P00352 5/20 0.34
PPARG P37231 5/20 0.34
NR2E3 Q9Y5X4 5/20 0.34
NCOR2 Q9Y618 5/20 0.34
NPSR1 Q6W5P4 3/20 0.34
LMNA P02545 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
BRCA1 P38398 1/20 0.32
KDM4E B2RXH2 4/20 0.32
HTT P42858 1/20 0.32
TP53 P04637 1/20 0.31
AHR P35869 2/20 0.31
L3MBTL1 Q9Y468 3/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL17405651 0.95 RXFP1 (0.34) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL17405529 0.93 RXFP1 (0.34) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL19986052 0.92 ALDH1A1 (0.38) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL19986085 0.92 AHR (0.38) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL17405730 0.92 RXFP1 (0.36) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL22011373 0.91 ALDH1A1 (0.32) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL17405280 0.91 RXFP1 (0.39) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL17405225 0.91 RXFP1 (0.39) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL19986047 0.90 TDP1 (0.36) RXFP1ALDH1A1PPARGNR2E3NCOR2
SCHEMBL19986056 0.90 PLA2G2A (0.33) RXFP1ALDH1A1PPARGNR2E3NCOR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed