SCHEMBL20849010

SCHEMBL20849010

N#Cc1cccc(-n2c3ccc(C(F)(F)F)cc3c3cc(C(F)(F)F)ccc32)c1-c1c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cccc1-n1c2ccc(C(F)(F)F)cc2c2cc(C(F)(F)F)ccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
AR P10275 4/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
PDK2 Q15119 1/20 0.33
CTSS P25774 1/20 0.33
PTPN5 P54829 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
MAT2A P31153 1/20 0.32
HRH1 P35367 1/20 0.32
HTR6 P50406 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 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
SCHEMBL20849018 0.96 KIF11 (0.35) KDM4EARGPBAR1TSHRSMN1; SMN2
SCHEMBL20848583 0.95 AR (0.34) KDM4EARGPBAR1TSHRSMN1; SMN2
SCHEMBL20849009 0.91 MAT2A (0.35) KDM4EARPDK2GRIN1GRIN2B
SCHEMBL20848582 0.91 AR (0.33) ARGPBAR1PDK2PTPN5HRH1
SCHEMBL20849333 0.90 GABRA1 (0.38) KDM4EARGPBAR1ALDH1A1PDK2
SCHEMBL20848940 0.90 AR (0.38) AR
SCHEMBL20848581 0.89 AR (0.34) KDM4EARSMN1; SMN2ALDH1A1GAA
SCHEMBL20849608 0.89 KIF11 (0.39) KDM4EARPDK2MAT2AGABRA1
SCHEMBL20848934 0.89 AR (0.33) KDM4EARGPBAR1ALDH1A1GAA
SCHEMBL22985431 0.88 ALOX5AP (0.36) KDM4EARGPBAR1TSHRSMN1; SMN2

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 KDM4E 1952/4885AR 3706/4885GPBAR1 3938/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 KDM4E 1952/4885AR 3706/4885GPBAR1 3938/4885

“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.