SCHEMBL19912463

SCHEMBL19912463

Cc1cc(-c2c(-n3c4ccccc4c4cc(C(C)(C)C)ccc43)cc(C#N)cc2-n2c3ccccc3c3cc(C(C)(C)C)ccc32)cc(C(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.34
RORC P51449 2/20 0.32
RXRA P19793 1/20 0.32
RXRG P48443 1/20 0.32
MAT2A P31153 1/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
PTGER4 P35408 1/20 0.31
AR P10275 1/20 0.30
TACR1 P25103 1/20 0.30
TAS2R14 Q9NYV8 1/20 0.30
GPBAR1 Q8TDU6 1/20 0.30
PGR P06401 1/20 0.30
NR1H3 Q13133 1/20 0.30
PDE9A O76083 1/20 0.30
PDE1C Q14123 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
SCHEMBL19912466 0.95 KIF11 (0.39) KIF11RORCRXRARXRGMAT2A
SCHEMBL19912464 0.95 RXRA (0.34) KIF11RXRARXRGMAT2A
SCHEMBL22564465 0.94 KIF11 (0.37) KIF11RORCRXRARXRGMAT2A
SCHEMBL19903636 0.94 KIF11 (0.37) KIF11RORCRXRARXRGMAT2A
SCHEMBL19912479 0.93 KIF11 (0.36) KIF11RORCRXRARXRGMAT2A
SCHEMBL19912467 0.92 KIF11 (0.33) KIF11RXRARXRGMAT2AAR
SCHEMBL19912498 0.91 RXRA (0.36) KIF11RXRARXRGMAT2APTGER4
SCHEMBL22822339 0.91 RORC (0.35) KIF11RORCPTGER4PGRPDE9A
SCHEMBL19912469 0.90 KIF11 (0.32) KIF11RXRARXRGMAT2AAR
SCHEMBL19912488 0.90 AR (0.36) KIF11RXRARXRGMAT2APTGER4

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 KIF11 3316/4885RORC 2874/4885RXRA 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.