SCHEMBL19909076

SCHEMBL19909076

Cc1cc(-c2cc(-n3c4ccccc4c4ccc(C(F)(F)F)cc43)c(-n3c4ccccc4c4ccc(C(F)(F)F)cc43)cc2C#N)cc(C)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.43
MAT2A P31153 5/20 0.37
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
XDH P47989 2/20 0.34
GRM5 P41594 3/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
AR P10275 1/20 0.33
CNR2 P34972 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL19919792 0.95 TSHR (0.38) KIF11MAT2ATSHRSMN1; SMN2XDH
SCHEMBL19909515 0.94 KIF11 (0.43) KIF11MAT2ATSHRSMN1; SMN2XDH
SCHEMBL19909531 0.91 NPSR1 (0.32) KIF11MAT2AKDM4E
SCHEMBL19909071 0.91 TSHR (0.36) KIF11MAT2ATSHRSMN1; SMN2XDH
SCHEMBL19913228 0.90 KIF11 (0.40) KIF11MAT2ATSHRSMN1; SMN2GRM5
SCHEMBL22170304 0.90 XDH (0.34) KIF11XDHABCG2ARKDM4E
SCHEMBL22563398 0.90 KIF11 (0.43) KIF11MAT2ATSHRSMN1; SMN2XDH
SCHEMBL19903504 0.89 KIF11 (0.44) KIF11MAT2ATSHRSMN1; SMN2XDH
SCHEMBL19909522 0.89 KIF11 (0.39) KIF11MAT2ATSHRSMN1; SMN2XDH
SCHEMBL19912577 0.89 KIF11 (0.43) KIF11MAT2ATSHRSMN1; SMN2XDH

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11588114-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-21 US disclosed
US-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-02 US disclosed
US-10665792-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2020-05-26 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
EP-3287451-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 EP 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 (3 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-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OPRM1, OR51E2 KIF11 3067/4885MAT2A 3296/4885TSHR 3463/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 KIF11 3082/4885MAT2A 3273/4885TSHR 3186/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 KIF11 3067/4885MAT2A 3296/4885TSHR 3463/4885

“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.