SCHEMBL22192205

SCHEMBL22192205

N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(Oc4ccc(C#N)cc4)cc3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.73
MEN1 O00255 2/20 0.73
KMT2A Q03164 2/20 0.73
KDM4E B2RXH2 1/20 0.73
LMNA P02545 1/20 0.73
POLB P06746 1/20 0.73
MAPT P10636 1/20 0.73
PKM P14618 1/20 0.73
MAPK1 P28482 1/20 0.73
IL18 Q14116 1/20 0.73
MLYCD O95822 1/20 0.64
NPC1 O15118 2/20 0.62
PARP15 Q460N3 1/20 0.61
PARP10 Q53GL7 1/20 0.61
PARP2 Q9UGN5 1/20 0.61
PGR P06401 1/20 0.61
NAMPT P43490 2/20 0.56
TP53 P04637 1/20 0.56
ALOX15 P16050 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL18177305 0.92 PGR (0.65) RAB9AMEN1KMT2AKDM4ELMNA
SCHEMBL6263516 0.90 MLYCD (0.76) RAB9AMEN1KMT2AKDM4ELMNA
SCHEMBL9337665 0.90 MLYCD (0.76) RAB9AMEN1KMT2AKDM4ELMNA
SCHEMBL14228193 0.88 MLYCD (0.61) RAB9AMEN1KMT2AKDM4ELMNA
SCHEMBL6801256 0.88 NPC1 (0.76) RAB9AMEN1KMT2AKDM4ELMNA
SCHEMBL7281985 0.88 NPC1 (0.76) RAB9AMEN1KMT2AKDM4ELMNA
SCHEMBL20764458 0.83 MLYCD (0.68) RAB9AMEN1KMT2APOLBMAPT
SCHEMBL31311100 0.83 MLYCD (0.68) RAB9AMEN1KMT2APOLBMAPT
SCHEMBL6800698 0.83 MLYCD (0.68) RAB9AMEN1KMT2AMLYCDNPC1
SCHEMBL7272760 0.83 MLYCD (0.68) RAB9AMEN1KMT2AMLYCDNPC1

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-10703911-B2 Organic colorant, coloring composition, and inkjet ink RICOH COMPANY, LTD. (JP) 2020-07-07 US disclosed