SCHEMBL22157121

SCHEMBL22157121

N#Cc1cc(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)c(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)cc1-c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.38
CYP11B2 P19099 3/20 0.38
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
FLT3 P36888 1/20 0.34
DHODH Q02127 1/20 0.34
ACLY P53396 1/20 0.34
NPSR1 Q6W5P4 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CNR1 P21554 1/20 0.32
HDAC8 Q9BY41 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
SCHEMBL22156576 0.96 CYP11B1 (0.36) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22156793 0.92 CYP11B1 (0.37) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22156567 0.91 ALDH1A1 (0.36) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22157109 0.90 CYP11B1 (0.38) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22156577 0.90 CYP11B1 (0.36) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22157200 0.89 CYP11B1 (0.42) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22155925 0.88 CYP11B1 (0.35) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22157181 0.88 SLC6A9 (0.38) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22156566 0.88 ALDH1A1 (0.34) CYP11B1CYP11B2ALDH1A1SMN1; SMN2LMNA
SCHEMBL22157151 0.86 CYP11B1 (0.38) CYP11B1CYP11B2SMN1; SMN2FLT3ACLY

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 CYP11B1 827/4885CYP11B2 531/4885ALDH1A1 1882/4885

“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.