SCHEMBL22960487

SCHEMBL22960487

COB(O)c1cccc(I)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 6/20 0.41
APP P05067 2/20 0.40
IDO1 P14902 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MGLL Q99685 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
THPO P40225 1/20 0.31
RAB9A P51151 1/20 0.31
HIF1A Q16665 1/20 0.31
EGFR P00533 2/20 0.31
MPO P05164 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA5A P35218 1/20 0.30
CA7 P43166 1/20 0.30

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
SCHEMBL20273151 0.79 ENPP2 (0.59) ENPP2CA1CA2KDM4EALDH1A1
SCHEMBL8297905 0.78 ACHE (0.44) ENPP2IDO1CA1CA2ALDH1A1
SCHEMBL1711771 0.78 ENPP2 (0.59) ENPP2CA1CA2ALDH1A1CA5A
SCHEMBL25559690 0.77 ENPP2 (0.40) ENPP2APPIDO1KDM4EALDH1A1
SCHEMBL787196 0.76 ENPP2 (0.56) ENPP2CA1CA2KDM4EALDH1A1
SCHEMBL16136505 0.76 ENPP2 (0.41) ENPP2IDO1CA1CA2ALDH1A1
SCHEMBL29582240 0.76 ENPP2 (0.46) ENPP2CA1CA2KDM4EALDH1A1
SCHEMBL16247947 0.76 ENPP2 (0.46) ENPP2CA1CA2KDM4EALDH1A1
SCHEMBL5182053 0.76 ALDH1A1 (0.61) ENPP2CA1CA2KDM4EALDH1A1
SCHEMBL19820142 0.76 ENPP2 (0.41) ENPP2ALDH1A1EGFRORAI1ORAI2

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-20210040079-A1 10H-phenothiazine ferroptosis inhibitor as well as the preparative method and the use thereof Chengdu Henghao Investment Co. Limited (CN) 2021-02-11 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-20210040079-A1 10H-phenothiazine ferroptosis inhibitor as well as the preparative method and the use thereof AIFM2, FECH, GPX4 ENPP2 3907/4885APP 479/4885IDO1 1626/4885

“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.