SCHEMBL22930617

SCHEMBL22930617

Cc1cccc2c1-c1ccc3oc4ccccc4c3c1C21c2ccccc2C2(c3ccccc3-c3ccccc32)c2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.35
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 3/20 0.32
GAA P10253 2/20 0.32
HSD17B10 Q99714 2/20 0.32
USP2 O75604 1/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
MAOA P21397 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
SCHEMBL18732428 0.88 KDM4E (0.32) PDK2KDM4EALDH1A1HPGDGAA
SCHEMBL22930618 0.87 PDK2 (0.34) PDK2KDM4EALDH1A1HPGDGAA
SCHEMBL22930708 0.87 KDM4E (0.35) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL22930616 0.85 ALOX5 (0.39) PDK2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL18731818 0.85 AHR (0.37) PDK2
SCHEMBL19299468 0.84 KDM4E (0.35) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL17879492 0.84 KDM4E (0.37) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL21742871 0.82 PDK2 (0.38) PDK2KDM4EALDH1A1HPGDGAA
SCHEMBL21742875 0.82 PDK2 (0.38) PDK2KDM4EALDH1A1HPGDGAA
SCHEMBL22930689 0.81 AHR (0.41) PDK2KDM4EALDH1A1HPGDGAA

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-10910567-B2 Double spiro-type compound and organic light emitting diode comprising same LG CHEM, LTD. 2021-02-02 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-10910567-B2 Double spiro-type compound and organic light emitting diode comprising same NR2E3, ALDH1A2, CRY1 PDK2 560/4885KDM4E 2977/4885ALDH1A1 35/4885

“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.