SCHEMBL19085016

SCHEMBL19085016

CCOC(=O)c1ccccc1-c1ccc2c(c1)sc1c3ccccc3c(Br)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
ERN1 O75460 1/20 0.40
METAP2 P50579 1/20 0.40
CCR6 P51684 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39
KDM4E B2RXH2 2/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39
GABRA4 P48169 1/20 0.39
GABRE P78334 1/20 0.39
GABRA6 Q16445 1/20 0.39
GABRG1 Q8N1C3 1/20 0.39

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
SCHEMBL19077641 0.85 ALOX5 (0.40) LMNAL3MBTL1ALOX5SLC6A3
SCHEMBL19084992 0.77 ALOX5 (0.48) TSHRERN1KDM4EMAPTGAA
SCHEMBL13966911 0.76 TSHR (0.53) TSHRERN1NPSR1KDM4ERXFP1
SCHEMBL19085046 0.75 MEN1 (0.44) TSHRERN1METAP2KDM4EGABRP
SCHEMBL19077654 0.73 ALOX5 (0.40) ALOX5
SCHEMBL19085049 0.73 ALOX5 (0.46) TSHRERN1KDM4EGABRPGABRD
SCHEMBL28454296 0.72 TSHR (0.57) TSHRNPSR1KDM4ERXFP1MAPT
SCHEMBL13776780 0.70 SLC6A3 (0.57) TSHRERN1NPSR1GABRA1GABRB1
SCHEMBL19082510 0.70 KDM4E (0.40) KDM4EGABRPGABRDGABRA1GABRB1
SCHEMBL29500171 0.69 TSHR (0.65) TSHRERN1NPSR1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170194573-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 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 (1 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-20170194573-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 TSHR 4461/4885ERN1 797/4885METAP2 4401/4885

“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.