SCHEMBL20848922

SCHEMBL20848922

Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2ccc(C#N)cc2-c2ccc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)cc2-n2c3ccc(-c4ccc(C)cc4C)cc3c3cc(-c4ccc(C)cc4C)ccc32)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
KIF11 P52732 1/20 0.33
ELANE P08246 5/20 0.33
CYP2C9 P11712 1/20 0.32
SCN9A Q15858 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
HCRTR1 O43613 2/20 0.32
HCRTR2 O43614 2/20 0.32
NSD2 O96028 1/20 0.30
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 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
SCHEMBL20849548 0.96 AR (0.34) ARPTGDR2KIF11ELANECYP2C9
SCHEMBL20849068 0.96 AR (0.34) ARPTGDR2KIF11ELANECYP2C9
SCHEMBL20849071 0.96 AR (0.35) ARPTGDR2KIF11ELANECYP2C9
SCHEMBL22985322 0.94 AR (0.35) ARKIF11ELANENSD2AKR1C3
SCHEMBL20848972 0.94 KIF11 (0.35) ARPTGDR2KIF11ELANECYP2C9
SCHEMBL21399464 0.93 KIF11 (0.36) ARPTGDR2KIF11ELANEHCRTR1
SCHEMBL20848928 0.93 PTGDR2 (0.33) ARPTGDR2KIF11ELANECYP2C9
SCHEMBL20848465 0.93 AR (0.39) ARPTGDR2KIF11ELANECYP2C9
SCHEMBL20848812 0.92 AR (0.35) ARKIF11ELANECYP2C9SCN9A
SCHEMBL20848745 0.92 AR (0.36) ARPTGDR2KIF11ELANECYP2C9

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 3706/4885PTGDR2 3905/4885KIF11 419/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885PTGDR2 3905/4885KIF11 419/4885

“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.