SCHEMBL22985185

SCHEMBL22985185

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1cccc(C#N)c1-c1c(-c2ccc(C(F)(F)F)cc2C#N)cccc1-n1c2ccccc2c2cc(C(C)(C)C)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.36
HRH1 P35367 2/20 0.34
HTR6 P50406 2/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
AR P10275 5/20 0.33
SCN9A Q15858 1/20 0.32
RORC P51449 1/20 0.32
GPBAR1 Q8TDU6 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PDK2 Q15119 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
CNR2 P34972 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
SCHEMBL22985187 0.96 AR (0.33) KIF11HRH1HTR6PPARGPPARA
SCHEMBL20848790 0.93 AR (0.35) KIF11HRH1HTR6PPARGPPARA
SCHEMBL22985648 0.92 ALOX5AP (0.35) HRH1HTR6ARSCN9AGPBAR1
SCHEMBL22985186 0.91 HTR6 (0.35) KIF11HRH1HTR6ARSCN9A
SCHEMBL22985446 0.90 KIF11 (0.33) KIF11HRH1HTR6PPARGPPARA
SCHEMBL22985646 0.90 KIF11 (0.33) KIF11HRH1HTR6ARSCN9A
SCHEMBL22985428 0.90 ALOX5AP (0.39) KIF11ARALOX5APFEN1SMN1; SMN2
SCHEMBL22985450 0.89 ALOX5AP (0.34) KIF11HRH1HTR6ARALOX5AP
SCHEMBL20848582 0.89 AR (0.33) KIF11HRH1HTR6PPARGPPARA
SCHEMBL20848853 0.88 KIF11 (0.34) KIF11HRH1HTR6ARSCN9A

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-10919880-B2 Organic molecules, in particular for use in optoelectronic devices CYNORA GMBH (DE) 2021-02-16 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-10919880-B2 Organic molecules, in particular for use in optoelectronic devices OCIAD1, OCIAD2, POU2F1 KIF11 525/4885HRH1 4849/4885HTR6 1860/4885

“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.