SCHEMBL23423628

SCHEMBL23423628

c1ccc(-c2cccc(Nc3cc4ccccc4c4c3oc3ccccc34)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.47
▸ AKR1C3 P42330 4/20 0.46
▸ FADS1 O60427 1/20 0.40
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ SIRT1 Q96EB6 1/20 0.39
▸ CDC25B P30305 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ HIF1A Q16665 1/20 0.38
▸ MEN1 O00255 5/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ POLB P06746 2/20 0.37
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ EGFR P00533 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
SCHEMBL23423974 0.90 EPHX2 (0.43) EPHX2AKR1C3CDC25BALDH1A1HPGD
SCHEMBL23423637 0.90 EPHX2 (0.43) EPHX2AKR1C3CDC25BALDH1A1HPGD
SCHEMBL18471148 0.89 ALDH1A1 (0.45) FADS1CDC25BALDH1A1HPGDTSHR
SCHEMBL17382501 0.89 MAPT (0.41) EPHX2AKR1C3ALDH1A1HPGDHSD17B10
SCHEMBL23424012 0.87 EPHX2 (0.37) EPHX2AKR1C3FADS1SIRT2SIRT1
SCHEMBL23423701 0.86 EPHX2 (0.36) EPHX2AKR1C3FADS1SIRT2SIRT1
SCHEMBL23424010 0.86 EPHX2 (0.36) EPHX2AKR1C3FADS1SIRT2SIRT1
SCHEMBL23424015 0.85 EPHX2 (0.35) EPHX2AKR1C3FADS1ALDH1A1ATM
SCHEMBL23423700 0.85 EPHX2 (0.36) EPHX2AKR1C3FADS1SIRT2SIRT1
SCHEMBL23423702 0.85 AKR1C3 (0.34) EPHX2AKR1C3FADS1ALDH1A1ATM

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-20210159422-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-05-27 — — 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-20210159422-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device ARNT, SUN2, AHR EPHX2 603/4885AKR1C3 3705/4885FADS1 2893/4885

“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.

Send feedback