SCHEMBL19912464

SCHEMBL19912464

Cc1cc(-c2c(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc(C#N)cc2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc(C(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.34
RXRG P48443 1/20 0.34
KIF11 P52732 3/20 0.34
MAT2A P31153 1/20 0.32
RAPGEF3 O95398 3/20 0.32
RAPGEF4 Q8WZA2 2/20 0.32
XDH P47989 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 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
SCHEMBL19912463 0.95 KIF11 (0.34) RXRARXRGKIF11MAT2A
SCHEMBL19918009 0.93 KIF11 (0.37) RXRARXRGKIF11MAT2ARAPGEF3
SCHEMBL22822245 0.93 RXRA (0.39) RXRARXRGKIF11MAT2ARAPGEF3
SCHEMBL19912483 0.92 KIF11 (0.38) RXRARXRGKIF11MAT2AXDH
SCHEMBL19912465 0.92 RXRA (0.34) RXRARXRGKIF11MAT2AXDH
SCHEMBL19912385 0.91 RXRA (0.36) RXRARXRGKIF11MAT2AXDH
SCHEMBL19912466 0.90 KIF11 (0.39) RXRARXRGKIF11MAT2A
SCHEMBL19912496 0.89 RXRA (0.39) RXRARXRGKIF11MAT2AXDH
SCHEMBL19912489 0.89 AR (0.40) RXRARXRGKIF11MAT2AXDH
SCHEMBL19903636 0.88 KIF11 (0.37) RXRARXRGKIF11MAT2ARAPGEF3

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.