SCHEMBL20849072

SCHEMBL20849072

Cc1cc(C)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2ccc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)cc2-n2c3ccccc3c3cc(-c4cc(C)cc(C)c4)ccc32)c1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.32
CYP2C9 P11712 1/20 0.32
SCN9A Q15858 1/20 0.32
AR P10275 3/20 0.32
KIF11 P52732 2/20 0.32
ELANE P08246 4/20 0.31
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 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
SCHEMBL20848746 0.97 PTGER4 (0.33) PTGER4CYP2C9SCN9AARKIF11
SCHEMBL20848722 0.96 KIF11 (0.33) CYP2C9SCN9AARKIF11ELANE
SCHEMBL22985326 0.95 AR (0.34) PTGER4ARKIF11
SCHEMBL20849524 0.94 AR (0.39) PTGER4CYP2C9SCN9AARKIF11
SCHEMBL20848464 0.94 AR (0.36) PTGER4CYP2C9SCN9AARKIF11
SCHEMBL21399713 0.93 KIF11 (0.35) PTGER4ARKIF11ELANEPTGDR2
SCHEMBL20848466 0.93 KIF11 (0.35) PTGER4CYP2C9SCN9AARKIF11
SCHEMBL20848980 0.92 KIF11 (0.33) PTGER4CYP2C9SCN9AARKIF11
SCHEMBL20848721 0.92 AR (0.32) PTGER4CYP2C9SCN9AARKIF11
SCHEMBL20849540 0.92 KIF11 (0.34) CYP2C9SCN9AARKIF11ELANE

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 PTGER4 3716/4885CYP2C9 725/4885SCN9A 1664/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 PTGER4 3716/4885CYP2C9 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.