SCHEMBL19912440

SCHEMBL19912440

Cc1cc(C)cc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3cc(C)cc(C(F)(F)F)c3)c(-n3c4ccccc4c4cc(-c5cc(C)cc(C)c5)ccc43)cc2C#N)c1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.36
KIF11 P52732 1/20 0.32
XDH P47989 1/20 0.31
NR3C1 P04150 1/20 0.31
PGR P06401 1/20 0.31
NR3C2 P08235 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
RORC P51449 1/20 0.30
PTGER4 P35408 1/20 0.30
ICMT O60725 2/20 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
SCHEMBL19912445 0.99 AR (0.37) ARKIF11XDHNR3C1PGR
SCHEMBL19918043 0.98 AR (0.36) ARKIF11XDHNR3C1PGR
SCHEMBL19912438 0.96 AR (0.36) ARXDHPGRCYP11B1CYP11B2
SCHEMBL19912419 0.95 AR (0.38) ARKIF11XDHNR3C1PGR
SCHEMBL19912452 0.95 AR (0.36) ARXDHPGRCYP11B1CYP11B2
SCHEMBL19912429 0.94 AR (0.44) ARXDHPGRPTGER4ICMT
SCHEMBL19912439 0.94 AR (0.36) ARKIF11XDHNR3C1PGR
SCHEMBL19918045 0.94 AR (0.36) ARXDHPGRCYP11B1CYP11B2
SCHEMBL19912433 0.93 AR (0.38) ARXDHICMT
SCHEMBL19912416 0.93 AR (0.39) ARXDHPGRCYP11B1CYP11B2

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 AR 4212/4885KIF11 3316/4885XDH 68/4885

“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.