SCHEMBL22376121

SCHEMBL22376121

c1ccc(-c2nc(-c3ccc4oc5ccccc5c4c3)nc(-c3ccc(-c4cccc5c4oc4ccccc45)c4oc5ccccc5c34)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.46
ALDH1A1 P00352 4/20 0.38
HPGD P15428 3/20 0.38
PRKDC P78527 2/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CB P42338 1/20 0.38
GGPS1 O95749 1/20 0.37
MAPT P10636 5/20 0.37
PTPRF P10586 2/20 0.36
PTPN2 P17706 2/20 0.36
PTPN1 P18031 2/20 0.36
KDM4E B2RXH2 2/20 0.36
POLB P06746 2/20 0.36
TSHR P16473 1/20 0.36
PIM1 P11309 1/20 0.36
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
CHEK2 O96017 1/20 0.36

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
SCHEMBL22375594 0.96 ALOX5 (0.45) ALOX5ALDH1A1HPGDPRKDCPIK3CD
SCHEMBL23349543 0.96 ALOX5 (0.46) ALOX5ALDH1A1HPGDPRKDCPIK3CD
SCHEMBL22376151 0.95 ALOX5 (0.49) ALOX5ALDH1A1HPGDPRKDCGGPS1
SCHEMBL22376242 0.95 ALOX5 (0.40) ALOX5ALDH1A1HPGDMAPTKDM4E
SCHEMBL24929382 0.94 ALOX5 (0.45) ALOX5ALDH1A1HPGDPRKDCPIK3CD
SCHEMBL22376345 0.94 ALOX5 (0.47) ALOX5ALDH1A1HPGDPRKDCPIK3CD
SCHEMBL24929436 0.94 ALOX5 (0.47) ALOX5ALDH1A1HPGDPRKDCPIK3CD
SCHEMBL22375680 0.94 ALOX5 (0.47) ALOX5ALDH1A1HPGDPRKDCPIK3CD
SCHEMBL23821996 0.94 ALOX5 (0.46) ALOX5ALDH1A1HPGDPRKDCPIK3CD
SCHEMBL22375730 0.93 ALOX5 (0.49) ALOX5ALDH1A1HPGDPRKDCGGPS1

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-20200274070-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2020-08-27 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-20200274070-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME ESR1, CCNA1, CCNE2 ALOX5 3623/4885ALDH1A1 444/4885HPGD 3060/4885

“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.