SCHEMBL22939802

SCHEMBL22939802

C=CC1=C(C=C)C2(c3ccccc31)c1ccccc1-c1cccc3cccc2c13

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ATM Q13315 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CASP1 P29466 2/20 0.35
CASP7 P55210 2/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
HIF1A Q16665 1/20 0.35
CYP3A4 P08684 1/20 0.33
PABPC1 P11940 1/20 0.33
DNMT1 P26358 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
KMT2A Q03164 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
SCHEMBL22646693 0.94 ALDH1A1 (0.34) MAPK1ALDH1A1TSHRHSD17B10ATM
SCHEMBL19152014 0.88 MEN1 (0.38) ALDH1A1TSHRKDM4EMEN1LMNA
SCHEMBL22435826 0.87 KDM4E (0.37) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL19752428 0.85 KDM4E (0.36) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL24796724 0.79 MEN1 (0.39) ALDH1A1TSHRKDM4EMEN1LMNA
SCHEMBL29516015 0.79 ALDH1A1 (0.54) MAPK1ALDH1A1TSHRHSD17B10ATM
SCHEMBL19974426 0.79 ALDH1A1 (0.54) MAPK1ALDH1A1TSHRHSD17B10ATM
SCHEMBL22882196 0.79 MLNR (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL23408733 0.78
SCHEMBL20130955 0.77 MEN1 (0.39) ALDH1A1TSHRATMKDM4EMEN1

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-20210036231-A1 Organic Electronic Device, Display and LIghting Devices Comprising the Same NOVALED GMBH (DE) 2021-02-04 US disclosed