SCHEMBL20848973

SCHEMBL20848973

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1ccc(C#N)cc1-c1ccc(-c2ccc(C(F)(F)F)cc2C(F)(F)F)cc1-n1c2ccccc2c2cc(C(C)(C)C)ccc21

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.34
AR P10275 4/20 0.33
RORC P51449 3/20 0.32
PTGER4 P35408 1/20 0.32
CYP2C9 P11712 1/20 0.32
SCN9A Q15858 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
ELANE P08246 2/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
NR3C1 P04150 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
SCHEMBL20848832 0.96 KIF11 (0.34) KIF11ARRORCPTGER4CYP2C9
SCHEMBL20848757 0.96 KIF11 (0.35) KIF11ARRORCPTGER4CYP2C9
SCHEMBL20848798 0.96 KIF11 (0.35) KIF11ARRORCPTGER4CYP2C9
SCHEMBL22985562 0.96 AR (0.34) KIF11ARRORCPTGER4NR3C1
SCHEMBL20849522 0.96 KIF11 (0.35) KIF11ARRORCCYP2C9SCN9A
SCHEMBL20848775 0.95 KIF11 (0.36) KIF11ARCYP2C9SCN9AALOX5AP
SCHEMBL20848776 0.94 KIF11 (0.35) KIF11ARCYP2C9SCN9AALOX5AP
SCHEMBL20848466 0.94 KIF11 (0.35) KIF11ARPTGER4CYP2C9SCN9A
SCHEMBL22985369 0.94 KIF11 (0.35) KIF11ARALOX5APFEN1ELANE
SCHEMBL22985329 0.94 KIF11 (0.34) KIF11ARPTGER4CYP2C9SCN9A

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 419/4885AR 3706/4885RORC 379/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 KIF11 419/4885AR 3706/4885RORC 379/4885

“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.