SCHEMBL22155103

SCHEMBL22155103

N#Cc1ccc(-c2cc3c4ccccc4c(Br)cc3c3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.40
TSHR P16473 1/20 0.38
METAP2 P50579 1/20 0.37
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
MAOB P27338 2/20 0.36
MMP3 P08254 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
XDH P47989 1/20 0.35
SLC22A12 Q96S37 1/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
PDK2 Q15119 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL13192001 0.89 TSHR (0.46) TNKSTSHRMETAP2CA1CA2
SCHEMBL13192425 0.88 MMP3 (0.47) TNKSTSHRMETAP2CA1CA2
SCHEMBL13171012 0.86 TSHR (0.48) TNKSTSHRMETAP2CA1CA2
SCHEMBL3634282 0.82 CA1 (0.44) TNKSTSHRCA1CA2MAOB
SCHEMBL13171073 0.81 TNKS (0.43) TNKSTSHRMETAP2CA1CA2
SCHEMBL29847362 0.81 TSHR (0.41) TNKSTSHRCA1CA2MAOB
SCHEMBL21313428 0.81 TSHR (0.41) TNKSTSHRCA1CA2MAOB
SCHEMBL14066870 0.81 TNKS (0.43) TNKSTSHRMETAP2CA1CA2
SCHEMBL13171003 0.80 CA1 (0.51) TNKSTSHRCA1CA2XDH
SCHEMBL16945603 0.80 CYP1A2 (0.40) TNKSMAOBPDK2

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-11296282-B2 Organic compound and organic electroluminescence device using the same LUMINESCENCE TECHNOLOGY CORP. (TW) 2022-04-05 US disclosed
US-20200203632-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2020-06-25 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-11296282-B2 Organic compound and organic electroluminescence device using the same SLCO4C1, EML4, SLCO2A1 TNKS 4797/4885TSHR 4244/4885METAP2 1453/4885
US-20200203632-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME SLCO4C1, EML4, SLCO2A1 TNKS 4797/4885TSHR 4244/4885METAP2 1453/4885

“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.