SCHEMBL19912503

SCHEMBL19912503

Cc1cc(C)cc(-c2ccc3c4ccccc4n(-c4cc(C#N)cc(-n5c6ccccc6c6ccc(-c7cc(C)cc(C)c7)cc65)c4-c4cc(C)cc(C(F)(F)F)c4)c3c2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.36
RXRG P48443 1/20 0.36
KIF11 P52732 2/20 0.34
AR P10275 2/20 0.32
TACR1 P25103 3/20 0.32
PDE9A O76083 1/20 0.32
PDE1C Q14123 1/20 0.32
SYK P43405 1/20 0.31
APP P05067 1/20 0.31
BACE1 P56817 1/20 0.31
PGR P06401 1/20 0.31
TAS2R14 Q9NYV8 1/20 0.30
GRM5 P41594 1/20 0.30
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30
PSENEN Q9NZ42 1/20 0.30
PDPK1 O15530 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
SCHEMBL19912499 0.99 RXRA (0.36) RXRARXRGKIF11ARTACR1
SCHEMBL19917940 0.98 RXRA (0.36) RXRARXRGKIF11ARTACR1
SCHEMBL22822129 0.98 RXRA (0.38) RXRARXRGKIF11ARTACR1
SCHEMBL19912492 0.96 AR (0.36) RXRARXRGKIF11ARTACR1
SCHEMBL19912472 0.95 RXRA (0.38) RXRARXRGKIF11ARTACR1
SCHEMBL19912501 0.95 RXRA (0.39) RXRARXRGKIF11ARSYK
SCHEMBL19912487 0.94 AR (0.40) RXRARXRGKIF11ARTACR1
SCHEMBL19912504 0.94 RXRA (0.36) RXRARXRGKIF11ARTACR1
SCHEMBL19912508 0.94 RXRA (0.40) RXRARXRGKIF11ARTACR1
SCHEMBL19913289 0.93 RXRA (0.33) RXRARXRGKIF11TACR1SYK

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 RXRA 3635/4885RXRG 3474/4885KIF11 3316/4885

“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.