SCHEMBL23487288

SCHEMBL23487288

Cc1cc(C)nc(-c2cc(-n3c4ccc(-c5cc(C(F)(F)F)cc(C(F)(F)F)c5)cc4c4cc(-c5cc(C(F)(F)F)cc(C(F)(F)F)c5)ccc43)c(C#N)cc2-n2c3ccc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)cc3c3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc32)n1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
CTSS P25774 2/20 0.33
CTSK P43235 2/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.32
AR P10275 4/20 0.32
ICMT O60725 3/20 0.32
XDH P47989 2/20 0.32
RXRA P19793 2/20 0.31
RXRB P28702 1/20 0.31
NAAA Q02083 1/20 0.31
PGR P06401 1/20 0.30
RXRG P48443 1/20 0.30

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
SCHEMBL22563392 0.93 CYP11B1 (0.34) CYP11B1CYP11B2CTSSCTSKPSEN1
SCHEMBL21108048 0.92 CYP11B1 (0.34) CYP11B1CYP11B2CTSSCTSKPSEN1
SCHEMBL23487634 0.92 CYP11B1 (0.34) CYP11B1CYP11B2CTSSCTSKPSEN1
SCHEMBL19919652 0.91 CYP11B1 (0.34) CYP11B1CYP11B2CTSSCTSKPSEN1
SCHEMBL23487633 0.90 ABCG2 (0.34) CYP11B1CYP11B2CTSSCTSKPSEN1
SCHEMBL19917977 0.87 CYP11B1 (0.36) CYP11B1CYP11B2CTSSCTSKAR
SCHEMBL19913257 0.86 AR (0.33) CYP11B1CYP11B2CTSSCTSKAR
SCHEMBL19909386 0.85 CYP11B1 (0.35) CYP11B1CYP11B2CTSSCTSKPSEN1
SCHEMBL19918045 0.85 AR (0.36) CYP11B1CYP11B2CTSSCTSKAR
SCHEMBL21109743 0.85 ABCG2 (0.34) CYP11B1CYP11B2CTSSABCG2ICMT

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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 CYP11B1 1451/4885CYP11B2 770/4885CTSS 4056/4885

“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.