SCHEMBL20849065

SCHEMBL20849065

Cc1cccc(-c2ccc3c(c2)c2cc(-c4cccc(C)c4)ccc2n3-c2ccc(-c3c(C(F)(F)F)cccc3C(F)(F)F)c(-c3cc(C#N)ccc3-n3c4ccc(-c5cccc(C)c5)cc4c4cc(-c5cccc(C)c5)ccc43)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.42
KIF11 P52732 1/20 0.31
ENPP1 P22413 1/20 0.31
PDK2 Q15119 2/20 0.31
NR3C1 P04150 1/20 0.31
ELANE P08246 2/20 0.30
SCN9A Q15858 1/20 0.30
CYP2C9 P11712 2/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL20849066 0.97 AR (0.39) ARENPP1PDK2
SCHEMBL20848628 0.95 AR (0.35) ARKIF11ELANESYK
SCHEMBL20849416 0.94 AR (0.38) ARKIF11PDK2ELANEALDH1A1
SCHEMBL22985056 0.92 AR (0.43) ARKIF11PDK2NR3C1ELANE
SCHEMBL20849492 0.92 KIF11 (0.35) ARKIF11PDK2PGR
SCHEMBL20849658 0.92 KIF11 (0.39) ARKIF11PDK2PGRSYK
SCHEMBL20848626 0.91 AR (0.33) ARSYK
SCHEMBL20849439 0.91 AR (0.34) ARELANE
SCHEMBL20849440 0.91 ELANE (0.32) ARELANE
SCHEMBL20849162 0.91 AR (0.45) ARKIF11ENPP1PDK2SCN9A

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 3706/4885KIF11 419/4885ENPP1 4565/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885KIF11 419/4885ENPP1 4565/4885

“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.