SCHEMBL20848802

SCHEMBL20848802

Cc1ccc2c(c1)c1ccccc1n2-c1cc(C#N)ccc1-c1ccc(-c2ccc(C(F)(F)F)cc2C(F)(F)F)cc1-n1c2ccccc2c2cc(C)ccc21

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.34
CYP2C9 P11712 1/20 0.34
SCN9A Q15858 1/20 0.34
AR P10275 4/20 0.34
ELANE P08246 4/20 0.33
PTGER4 P35408 1/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
HCRTR1 O43613 2/20 0.32
HCRTR2 O43614 2/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
NSD2 O96028 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 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
SCHEMBL20848835 0.96 KIF11 (0.33) KIF11CYP2C9SCN9AARELANE
SCHEMBL20848980 0.96 KIF11 (0.33) KIF11CYP2C9SCN9AARELANE
SCHEMBL20848797 0.95 KIF11 (0.36) KIF11CYP2C9SCN9AARELANE
SCHEMBL20848433 0.95 AR (0.37) KIF11CYP2C9SCN9AARELANE
SCHEMBL22985303 0.94 AR (0.36) KIF11ARELANEPTGER4NSD2
SCHEMBL20848817 0.93 KIF11 (0.36) KIF11CYP2C9SCN9AARELANE
SCHEMBL20848816 0.93 KIF11 (0.36) KIF11CYP2C9SCN9AARELANE
SCHEMBL20849544 0.93 KIF11 (0.36) KIF11CYP2C9SCN9AARELANE
SCHEMBL20848430 0.93 AR (0.41) KIF11CYP2C9SCN9AARELANE
SCHEMBL22985689 0.92 KIF11 (0.36) KIF11CYP2C9SCN9AARELANE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10978646-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-13 US disclosed
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-28 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 (2 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-10978646-B2 Organic molecules for use in optoelectronic devices OCIAD2, OCIAD1, POU2F1 KIF11 419/4885CYP2C9 725/4885SCN9A 1664/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 KIF11 419/4885CYP2C9 725/4885SCN9A 1664/4885

“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.