SCHEMBL22822158

SCHEMBL22822158

Cc1ccc(-c2ccc3c4ccc(-c5ccc(C)cc5)cc4n(-c4cc(C#N)c(-c5cc(C#N)cc(C(F)(F)F)c5)cc4-n4c5cc(-c6ccc(C)cc6)ccc5c5ccc(-c6ccc(C)cc6)cc54)c3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.43
RXRA P19793 1/20 0.39
RXRG P48443 1/20 0.39
KIF11 P52732 2/20 0.35
XDH P47989 3/20 0.34
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
MAOA P21397 3/20 0.33
MAOB P27338 2/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 1/20 0.31
METAP2 P50579 1/20 0.31
APP P05067 1/20 0.31

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
SCHEMBL22822438 0.95 AR (0.39) ARRXRARXRGKIF11XDH
SCHEMBL22822291 0.93 AR (0.42) ARRXRARXRGKIF11XDH
SCHEMBL20617046 0.93 RXRA (0.37) ARRXRARXRGKIF11XDH
SCHEMBL22822157 0.92 AR (0.43) ARRXRARXRGKIF11XDH
SCHEMBL22822580 0.91 RXRA (0.42) ARRXRARXRGKIF11XDH
SCHEMBL20617110 0.91 RXRA (0.42) ARRXRARXRGKIF11XDH
SCHEMBL22822436 0.91 AR (0.46) ARRXRARXRGXDHPGR
SCHEMBL22564183 0.91 RXRA (0.42) ARRXRARXRGKIF11XDH
SCHEMBL20925053 0.90 RXRA (0.41) RXRARXRGKIF11XDHCYP11B1
SCHEMBL19918025 0.90 AR (0.41) ARKIF11XDHMAOAMAOB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021473-B2 Organic molecules for use in organic optoelectronic devices CYNORA GMBH (DE) 2021-06-01 US disclosed
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-24 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 (2 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-11021473-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OCIAD2 AR 4374/4885RXRA 3552/4885RXRG 3138/4885
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 AR 4325/4885RXRA 3876/4885RXRG 3543/4885

“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.