SCHEMBL6928767

SCHEMBL6928767

CCCC1c2ccccc2-c2ccc(-c3ccc4c(c3)Cc3cc(-c5ccc6c(c5)Cc5ccccc5-6)ccc3-4)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HTR2A P28223 10/20 0.40
HRH1 P35367 8/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
TSHR P16473 1/20 0.37
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PGR P06401 1/20 0.37
CYP1A2 P05177 2/20 0.36

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
SCHEMBL5502448 0.81 MMP12 (0.34) NPC1RAB9ASLC6A2SLC6A4SLC6A3
SCHEMBL30673022 0.77 MAPT (0.46) NPC1RAB9AHTR2ASLC6A2SLC6A4
SCHEMBL3414807 0.75 ALDH1A1 (0.63) NPC1RAB9AHTR2ASLC6A2SLC6A4
SCHEMBL30395577 0.75 ALDH1A1 (0.63) NPC1RAB9AHTR2ASLC6A2SLC6A4
SCHEMBL1996543 0.75 HTR2A (0.54) HTR2AHRH1SLC6A2SLC6A4SLC6A3
SCHEMBL13303151 0.72 DYRK1A (0.44) RAB9AHTR2AALDH1A1LMNAMAPT
SCHEMBL28440412 0.72 ALDH1A1 (0.59) NPC1RAB9AHTR2ASLC6A2SLC6A4
SCHEMBL1666630 0.70 MAPT (0.57) NPC1RAB9ASLC6A2SLC6A4SLC6A3
SCHEMBL1482804 0.70 MAPT (0.57) NPC1RAB9ASLC6A2SLC6A4SLC6A3
SCHEMBL30172496 0.70 MAPT (0.57) NPC1RAB9ASLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030039838-A1 Light-emitting organic oligomer compositions UNIVERSITY OF ROCHESTER 2003-02-27 US disclosed