SCHEMBL21074294

SCHEMBL21074294

Cc1ccccc1N1c2ncccc2N(C(C)C)C1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
HKDC1 Q2TB90 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KMT2A Q03164 3/20 0.35
FLT3 P36888 2/20 0.35
GSK3B P49841 2/20 0.35
MEN1 O00255 2/20 0.33
BRD4 O60885 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
KDR P35968 1/20 0.32
LMNA P02545 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL16727551 1.00 ALDH1A1 (0.36) ALDH1A1KDM4ETDP1HPGDTSHR
SCHEMBL16727564 0.89 KMT2A (0.36) ALDH1A1KDM4ETDP1HPGDTSHR
SCHEMBL21074281 0.87 HCAR1 (0.34) ALDH1A1KDM4ETDP1HPGDTSHR
SCHEMBL19999695 0.87 HCAR1 (0.34) ALDH1A1KDM4ETDP1HPGDTSHR
SCHEMBL16727566 0.85 KDM4E (0.33) ALDH1A1KDM4ETDP1HPGDTSHR
SCHEMBL20865142 0.84 ALDH1A1 (0.32) ALDH1A1KDM4ETDP1HPGDTSHR
SCHEMBL16199507 0.84 KMT2A (0.36) KDM4EKMT2ABRD4MYC
SCHEMBL23998675 0.83 ALDH1A1 (0.41) ALDH1A1KDM4ETDP1HPGDTSHR
SCHEMBL16726495 0.81 KDM4E (0.38) ALDH1A1KDM4ETDP1HPGDTSHR
SCHEMBL11995100 0.81 KDM4E (0.38) ALDH1A1KDM4ETDP1HPGDTSHR

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
EP-3492480-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2021-10-20 EP disclosed
EP-3492480-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2019-06-05 EP disclosed