SCHEMBL19986077

SCHEMBL19986077

c1ccc2c(c1)oc1cc(-c3ccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)cc3)ccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MMP12 P39900 1/20 0.35
MMP13 P45452 1/20 0.35
ATM Q13315 1/20 0.35
AHR P35869 3/20 0.35
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
ALDH1A1 P00352 4/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 2/20 0.34
HPGD P15428 1/20 0.34
HCRTR1 O43613 1/20 0.33
PRKDC P78527 1/20 0.32
ALOX5 P09917 1/20 0.32
PTGER4 P35408 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
BRCA1 P38398 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL19986066 0.93 ALDH1A1 (0.35) NPC1RAB9AAHRMEN1KMT2A
SCHEMBL19986056 0.93 PLA2G2A (0.33) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL19986064 0.91 AHR (0.33) NPC1RAB9AMMP12MMP13ATM
SCHEMBL19997990 0.91 MMP12 (0.38) NPC1RAB9AMMP12MMP13ATM
SCHEMBL19986085 0.90 AHR (0.38) NPC1RAB9AAHRMEN1KMT2A
SCHEMBL19986020 0.89 PLA2G2A (0.38) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL19986007 0.89 KDM4E (0.37) ATMMEN1KMT2AALDH1A1MAPT
SCHEMBL19986042 0.89 KDM4E (0.37) ATMMEN1KMT2AALDH1A1MAPT
SCHEMBL19986061 0.89 KDM4E (0.40) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL17246279 0.88 NPC1 (0.35) NPC1RAB9AMMP12MMP13ATM

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