SCHEMBL21547065

SCHEMBL21547065

Cc1ccc2c3ccccc3n(-c3cc(-c4cccc(C#N)c4)cc(-n4c5ccccc5c5ccc(C)cc54)c3C(F)(F)F)c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.38
PTPN5 P54829 1/20 0.37
AR P10275 1/20 0.37
PDK2 Q15119 1/20 0.35
ENPP1 P22413 1/20 0.34
ALDH1A3 P47895 1/20 0.34
CYP1A2 P05177 4/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP3A4 P08684 3/20 0.33
TSHR P16473 3/20 0.33
MEN1 O00255 2/20 0.33
CYP2C19 P33261 2/20 0.33
KMT2A Q03164 2/20 0.33
CLK4 Q9HAZ1 2/20 0.33
MAPK1 P28482 2/20 0.33
LMNA P02545 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MAT2A P31153 1/20 0.33

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
SCHEMBL21547061 0.96 SYK (0.41) SYKPTPN5ARPDK2ENPP1
SCHEMBL21547059 0.94 AR (0.43) SYKPTPN5ARPDK2ENPP1
SCHEMBL22760829 0.94 PTPN5 (0.41) SYKPTPN5ARPDK2ENPP1
SCHEMBL21547066 0.94 SYK (0.38) SYKPTPN5ARPDK2ENPP1
SCHEMBL22761250 0.92 SYK (0.41) SYKPTPN5ARPDK2ENPP1
SCHEMBL22761171 0.91 PTPN5 (0.43) SYKPTPN5PDK2ENPP1ALDH1A3
SCHEMBL22760793 0.91 PTPN5 (0.40) SYKPTPN5PDK2ENPP1ALDH1A3
SCHEMBL22760828 0.89 PTPN5 (0.41) SYKPTPN5ARPDK2ENPP1
SCHEMBL21547153 0.89 PTPN5 (0.41) SYKPTPN5ARPDK2ALDH1A3
SCHEMBL21547063 0.89 AR (0.46) SYKPTPN5ARPDK2ALDH1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10981930-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-20 US disclosed
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-10 US disclosed
EP-3478793-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-11-06 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 (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-10981930-B2 Organic molecules for use in optoelectronic devices OR10J3, OR51E2, EPCAM SYK 1131/4885PTPN5 4550/4885AR 4523/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM SYK 1131/4885PTPN5 4550/4885AR 4523/4885

“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.