SCHEMBL22870943

SCHEMBL22870943

COC(=O)c1ccccc1-c1ccc2c3ccc(-c4ccccc4C(=O)OC)cc3c3nc4c(-c5cccc6c5sc5ccccc56)sc(-c5cccc6c5sc5ccccc56)c4nc3c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 4/20 0.46
SLC6A4 P31645 3/20 0.46
SLC6A2 P23975 1/20 0.46
ALOX5 P09917 1/20 0.43
PARP14 Q460N5 1/20 0.41
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
ROCK2 O75116 1/20 0.39
CSF1R P07333 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
CDK5 Q00535 1/20 0.39
ROCK1 Q13464 1/20 0.39
SLK Q9H2G2 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
ATM Q13315 2/20 0.38
TDP1 Q9NUW8 2/20 0.38

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
SCHEMBL22870967 0.88 ALOX5 (0.46) ALOX5PARP14ALDH1A1MEN1KMT2A
SCHEMBL22870557 0.85 SLC6A3 (0.47) SLC6A3SLC6A4SLC6A2CNR1CNR2
SCHEMBL10108865 0.78 PARP14 (0.59) SLC6A3SLC6A4SLC6A2ALOX5PARP14
SCHEMBL22870741 0.78 ALOX5 (0.45) ALOX5PARP14ALDH1A1MAPTHPGD
SCHEMBL22870703 0.76 ALOX5 (0.44) ALOX5LMNAMAPK1ALDH1A1MEN1
SCHEMBL29325616 0.75 EGFR (0.40) CNR1CNR2L3MBTL1ATMTDP1
SCHEMBL29325889 0.74 ALOX5 (0.42) ALOX5PARP14CDK5L3MBTL1ATM
SCHEMBL21185975 0.74 ALOX5 (0.54) ALOX5PARP14CDK5L3MBTL1ATM
SCHEMBL22871123 0.73 MAPT (0.44) ALOX5PARP14CNR1CNR2L3MBTL1
SCHEMBL22870719 0.73 TNKS (0.41) ALOX5PARP14CDK5L3MBTL1ATM

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
US-12043627-B2 Compound and color conversion film comprising same LG CHEM, LTD. (KR) 2024-07-23 US disclosed
US-12043627-B2 Compound and color conversion film comprising same LG CHEM, LTD. (KR) 2024-07-23 US disclosed
US-20210002294-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME LG CHEM, LTD. (KR) 2021-01-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210002294-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME CRY1, FLI1, FDFT1 SLC6A3 1230/4885SLC6A4 2502/4885SLC6A2 1904/4885
US-12043627-B2 Compound and color conversion film comprising same CRY1, FLI1, FDFT1 SLC6A3 1230/4885SLC6A4 2502/4885SLC6A2 1904/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.