SCHEMBL19912481

SCHEMBL19912481

Cc1cc(-c2c(-n3c4cc(-c5ccccc5C)ccc4c4ccc(-c5ccccc5C)cc43)cc(C#N)cc2-n2c3cc(-c4ccccc4C)ccc3c3ccc(-c4ccccc4C)cc32)cc(C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.42
GPBAR1 Q8TDU6 3/20 0.37
RXRA P19793 1/20 0.33
RXRG P48443 1/20 0.33
PDK2 Q15119 1/20 0.31
KIF11 P52732 1/20 0.30
XDH P47989 1/20 0.30
SLC22A12 Q96S37 1/20 0.30
GRIA2 P42262 1/20 0.30
GRIA4 P48058 1/20 0.30
TAS2R14 Q9NYV8 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
SCHEMBL19912477 0.97 AR (0.40) ARGPBAR1RXRARXRGKIF11
SCHEMBL19903445 0.95 AR (0.45) ARGPBAR1RXRARXRGPDK2
SCHEMBL22564402 0.95 AR (0.45) ARGPBAR1RXRARXRGPDK2
SCHEMBL19912486 0.92 AR (0.42) ARGPBAR1RXRARXRGPDK2
SCHEMBL19903541 0.92 AR (0.42) ARGPBAR1RXRARXRGPDK2
SCHEMBL22564398 0.92 AR (0.42) ARGPBAR1RXRARXRGPDK2
SCHEMBL19912478 0.92 AR (0.40) ARGPBAR1RXRARXRGKIF11
SCHEMBL19912493 0.90 RXRA (0.33) ARRXRARXRGKIF11XDH
SCHEMBL19912491 0.90 AR (0.33) ARRXRARXRGKIF11
SCHEMBL19912509 0.89 AR (0.35) ARGPBAR1RXRARXRGKIF11

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-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 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-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 AR 4212/4885GPBAR1 3858/4885RXRA 3635/4885

“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.