SCHEMBL20061825

SCHEMBL20061825

c1ccc2c(c1)C1c3ccccc3C2c2cc3cocc3cc21

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL20061808 0.84 KDM4E (0.33) KDM4EALDH1A1CYP3A4PKMHPGD
SCHEMBL20061802 0.82 NPC1 (0.30) ALDH1A1MAPT
SCHEMBL20061798 0.82 APAF1 (0.32) ALDH1A1HPGD
SCHEMBL31379941 0.79 ALDH1A1 (0.42) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL31123508 0.79 ALDH1A1 (0.42) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL20061804 0.79 EGFR (0.35) KDM4E
SCHEMBL13376392 0.79 HSP90AA1 (0.35) MEN1KMT2AALDH1A1TP53CYP3A4
SCHEMBL545454 0.72 MEN1 (0.53) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL29490140 0.72 MEN1 (0.53) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL12308998 0.72 DDB1 (0.31)

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-20180108848-A1 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-04-19 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-20180108848-A1 Organic electroluminescent materials and devices OSBP, OSBP2, OCIAD2 MEN1 3977/4885KMT2A 4509/4885GAA 4177/4885

“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.