SCHEMBL21399449

SCHEMBL21399449

Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2ccc(C(F)(F)F)cc2-c2c(C#N)cccc2-n2c3ccc(-c4ccc(C)cc4C)cc3c3cc(-c4ccc(C)cc4C)ccc32)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.36
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
XDH P47989 1/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
HCRTR1 O43613 2/20 0.32
HCRTR2 O43614 2/20 0.32
BCAT1 P54687 1/20 0.31
HTR6 P50406 2/20 0.31
HRH1 P35367 1/20 0.31
RAF1 P04049 1/20 0.31
BRAF P15056 1/20 0.31
PTGDR2 Q9Y5Y4 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
SCHEMBL21399450 0.96 AR (0.36) ARTSHRSMN1; SMN2XDHALOX5AP
SCHEMBL22985667 0.95 ALOX5AP (0.36) ARTSHRSMN1; SMN2XDHALOX5AP
SCHEMBL22985225 0.92 ALOX5AP (0.35) ARTSHRSMN1; SMN2XDHALOX5AP
SCHEMBL20849225 0.92 AR (0.35) ARXDH
SCHEMBL21399572 0.92 TSHR (0.36) ARTSHRSMN1; SMN2XDHALOX5AP
SCHEMBL20849517 0.91 AR (0.37) ARTSHRSMN1; SMN2
SCHEMBL21399501 0.90 TSHR (0.39) ARTSHRSMN1; SMN2HTR6HRH1
SCHEMBL20848954 0.90 AR (0.40) AR
SCHEMBL22985521 0.90 ALOX5AP (0.39) ARTSHRSMN1; SMN2XDHALOX5AP
SCHEMBL22984987 0.89 AR (0.37) ARTSHRSMN1; SMN2XDHALOX5AP

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-20190292151-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-26 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-20190292151-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, NR2E3, FOXO3 AR 1991/4885TSHR 260/4885SMN1; SMN2 3631/4885

“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.