SCHEMBL20848744

SCHEMBL20848744

Cc1cc(C)c(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2cc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)ccc2-n2c3ccccc3c3cc(-c4c(C)cc(C)cc4C)ccc32)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.34
ELANE P08246 6/20 0.33
PTGER4 P35408 1/20 0.33
CYP2C9 P11712 1/20 0.33
SCN9A Q15858 1/20 0.33
KIF11 P52732 2/20 0.32
PTGDR2 Q9Y5Y4 2/20 0.32
MAT2A P31153 1/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
TRPA1 O75762 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
SCHEMBL22985269 0.95 AR (0.36) ARELANEPTGER4KIF11TRPA1
SCHEMBL20848725 0.93 AR (0.34) ARELANEPTGER4CYP2C9SCN9A
SCHEMBL20848745 0.93 AR (0.36) ARELANEPTGER4CYP2C9SCN9A
SCHEMBL20848746 0.92 PTGER4 (0.33) ARELANEPTGER4CYP2C9SCN9A
SCHEMBL20848807 0.92 KIF11 (0.33) ARELANECYP2C9SCN9AKIF11
SCHEMBL20848928 0.92 PTGDR2 (0.33) ARELANECYP2C9SCN9AKIF11
SCHEMBL20849067 0.92 KIF11 (0.36) ARELANEPTGER4CYP2C9SCN9A
SCHEMBL22985484 0.91 ALOX5AP (0.36) ARELANEPTGER4KIF11PTGDR2
SCHEMBL22985094 0.91 AR (0.35) ARELANEPTGER4TRPA1
SCHEMBL20848841 0.91 AR (0.43) ARELANEPTGER4CYP2C9SCN9A

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 AR 3706/4885ELANE 4164/4885PTGER4 3716/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885ELANE 4164/4885PTGER4 3716/4885

“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.