SCHEMBL23313727

SCHEMBL23313727

c1ccc(-c2cc(Nc3ccc4c(c3)sc3ccccc34)ccc2-c2cccc3c2oc2ccccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
GGPS1 O95749 1/20 0.35
PTGES2 Q9H7Z7 1/20 0.35
F9 P00740 1/20 0.34
PRKDC P78527 6/20 0.34
C3AR1 Q16581 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
PTGIR P43119 1/20 0.32
EPHX2 P34913 1/20 0.32
BRDT Q58F21 2/20 0.31
PIK3CD O00329 2/20 0.31
PIK3CB P42338 2/20 0.31
BRD4 O60885 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
SCHEMBL23314002 0.86 ALOX5 (0.41) ALOX5GGPS1PTGES2F9PRKDC
SCHEMBL23372430 0.86 ALOX5 (0.35) ALOX5F9PRKDCALDH1A1MAPT
SCHEMBL19269612 0.84 ALOX5 (0.49) ALOX5GGPS1PTGES2PRKDCC3AR1
SCHEMBL23281592 0.83 ALOX5 (0.43) ALOX5GGPS1PTGES2F9PRKDC
SCHEMBL23313998 0.82 ALOX5 (0.40) ALOX5GGPS1PTGES2PRKDCALDH1A1
SCHEMBL23314036 0.82 PARP14 (0.40) ALOX5GGPS1PTGES2F9PRKDC
SCHEMBL23822231 0.82 MAPT (0.44) F9ALDH1A1MAPTHPGDRAB9A
SCHEMBL25636279 0.82 PTGIR (0.41) ALOX5PTGES2ALDH1A1MAPTHPGD
SCHEMBL26367018 0.82 ALOX5 (0.48) ALOX5GGPS1PTGES2PRKDCMAPT
SCHEMBL23313701 0.82 ALOX5 (0.48) ALOX5GGPS1PTGES2PRKDCALDH1A1

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-20210126197-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-04-29 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-20210126197-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE PIEZO1, L1CAM, AOC1 ALOX5 1383/4885GGPS1 2850/4885PTGES2 4015/4885

“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.