SCHEMBL22158378

SCHEMBL22158378

N#Cc1cc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c(-c2c(F)cccc2F)c(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACLY P53396 4/20 0.35
TSPO P30536 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
PGR P06401 1/20 0.34
FLT3 P36888 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
PTPN5 P54829 1/20 0.32
PTGER4 P35408 1/20 0.32
KIF11 P52732 1/20 0.32
GRIA2 P42262 1/20 0.31
GRIA4 P48058 1/20 0.31
ALDH1A3 P47895 1/20 0.31
METAP2 P50579 1/20 0.31

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
SCHEMBL22156828 0.96 ACLY (0.37) ACLYCYP11B1CYP11B2PGRFLT3
SCHEMBL23348472 0.94 PGR (0.35) ACLYCYP11B1CYP11B2PGRFLT3
SCHEMBL22158380 0.93 PGR (0.36) ACLYCYP11B1CYP11B2PGRFLT3
SCHEMBL22156621 0.90 CYP1A2 (0.39) PTGER4
SCHEMBL22156686 0.89 TSPO (0.35) ACLYTSPOCYP11B1CYP11B2PGR
SCHEMBL22156891 0.89 CYP11B1 (0.38) CYP11B1CYP11B2FLT3GABRG2GABRB3
SCHEMBL22156823 0.89 PGR (0.38) ACLYCYP11B1CYP11B2PGRFLT3
SCHEMBL22158387 0.89 TGFBR1 (0.36) FLT3GABRG2GABRB3GABRA5GABRA3
SCHEMBL22156430 0.89 SLC6A9 (0.35) CYP11B1CYP11B2FLT3GABRG2GABRB3
SCHEMBL21546583 0.87 ALDH1A3 (0.40) TSPOPGRGABRG2GABRB3GABRA5

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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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 (1 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 ACLY 3217/4885TSPO 499/4885CYP11B1 827/4885

“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.