SCHEMBL21742928

SCHEMBL21742928

c1ccc2c(c1)ccc1ccc(CN3CCOCC3)cc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.58
ALDH1A1 P00352 5/20 0.58
KDM4E B2RXH2 4/20 0.58
MAPT P10636 2/20 0.58
LMNA P02545 1/20 0.58
GAA P10253 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
MEN1 O00255 1/20 0.56
PARP1 P09874 1/20 0.54
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
TSHR P16473 2/20 0.54
TP53 P04637 1/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53
HRH3 Q9Y5N1 2/20 0.53
NCF1 P14598 1/20 0.53
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51

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
SCHEMBL20021994 0.85 KMT2A (0.70) KMT2AALDH1A1KDM4ENPC1RAB9A
SCHEMBL11196105 0.76 NCF1 (0.83) KMT2AALDH1A1KDM4EMEN1PARP1
SCHEMBL28158277 0.76 SIGMAR1 (0.68) KMT2AALDH1A1KDM4ELMNAMEN1
SCHEMBL349204 0.76 CHEK1 (0.53) ALDH1A1MAPTPARP1NPC1RAB9A
SCHEMBL4106102 0.76 ALDH1A1 (0.68) KMT2AALDH1A1KDM4EMAPTLMNA
SCHEMBL15467001 0.75 HRH3 (0.87) KMT2AALDH1A1MAPTLMNAMEN1
SCHEMBL348688 0.75 PARP1 (0.45) ALDH1A1KDM4EPARP1NPC1RAB9A
SCHEMBL9986621 0.75 TP53 (0.73) KMT2AALDH1A1KDM4EMAPTLMNA
SCHEMBL5168930 0.75 NPC1 (0.57) KMT2AALDH1A1KDM4EMAPTLMNA
SCHEMBL5017070 0.74 NPC1 (0.57) KMT2AALDH1A1KDM4EMAPTLMNA

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-20200056181-A1 Aptamers to PDGF and VEGF and Their Use in Treating PDGF and VEGF Mediated Conditions SOMALOGIC OPERATING CO., INC. 2020-02-20 US disclosed