SCHEMBL9352152

SCHEMBL9352152

COCOCc1c(OC)cc(OC)cc1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
MAPK1 P28482 4/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
G6PD P11413 1/20 0.41
PKM P14618 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
ALDH1A1 P00352 6/20 0.39
TDP1 Q9NUW8 2/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
PRKDC P78527 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HPGD P15428 1/20 0.37

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
SCHEMBL9348507 0.81 PTPN1 (0.45) MAPTMAPK1KMT2AKDM4EMEN1
SCHEMBL9348386 0.80 ALDH1A1 (0.41) MAPTKMT2AKDM4EMEN1PKM
SCHEMBL8744254 0.79 MAPT (0.45) MAPTMAPK1KMT2AKDM4EMEN1
SCHEMBL9349868 0.75 CRHR1 (0.35) MAPK1ALDH1A1CYP3A4SMN1; SMN2
SCHEMBL9348473 0.75 ALDH1A1 (0.51) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL9348359 0.74 ALDH1A1 (0.41) MAPTMAPK1KMT2AMEN1ALDH1A1
SCHEMBL9348450 0.74 ALDH1A1 (0.34) MAPTMAPK1KMT2AKDM4EMEN1
SCHEMBL9348362 0.74 CYP3A4 (0.33) MAPK1ALDH1A1CYP3A4SMN1; SMN2
SCHEMBL2591957 0.72 MAPK1 (0.50) MAPTMAPK1KMT2AKDM4EMEN1
SCHEMBL8458580 0.70 MAPT (0.49) MAPTMAPK1KMT2AKDM4EMEN1

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
WO-1992016509-A1 MULTISUBSTITUTED 1-HYDROXY-9-ACRIDONES WITH ANTICANCER ACTIVITY SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1992-10-01 WO claimed
US-5296602-A Condensing substituted ortho-halo- or ortho-aminobenzoic acid with meta-halo- or meta-aminoanisole, cyclizing, N-alkylating, de-O-methylating SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1994-03-22 US disclosed
WO-1992016509-A1 MULTISUBSTITUTED 1-HYDROXY-9-ACRIDONES WITH ANTICANCER ACTIVITY SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1992-10-01 WO disclosed