SCHEMBL19912412

SCHEMBL19912412

Cc1cc(-c2cc(-n3c4ccccc4c4cc(C(C)(C)C)ccc43)c(C#N)cc2-n2c3ccccc3c3cc(C(C)(C)C)ccc32)cc(C(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.34
AR P10275 5/20 0.33
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33
RORC P51449 1/20 0.32
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
SLC22A12 Q96S37 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL19917907 0.96 KIF11 (0.38) KIF11ARNR3C1PGRNR3C2
SCHEMBL19912384 0.96 TSHR (0.32) KIF11ARTSHRSMN1; SMN2
SCHEMBL19912407 0.95 KIF11 (0.38) KIF11ARNR3C1PGRNR3C2
SCHEMBL19912410 0.94 KIF11 (0.32) KIF11TSHRSMN1; SMN2
SCHEMBL19912570 0.94 KIF11 (0.34) KIF11ARNR3C1PGRNR3C2
SCHEMBL19918034 0.94 KIF11 (0.36) KIF11ARPGRRORCPPARG
SCHEMBL19912422 0.93 KIF11 (0.36) KIF11ARNR3C1PGRNR3C2
SCHEMBL19912383 0.93 KIF11 (0.36) KIF11ARNR3C1PGRNR3C2
SCHEMBL19912413 0.92 AR (0.35) KIF11ARNR3C1PGRNR3C2
SCHEMBL19912445 0.91 AR (0.37) KIF11ARNR3C1PGRNR3C2

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 3316/4885AR 4212/4885NR3C1 3779/4885

“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.