SCHEMBL20061784

SCHEMBL20061784

c1ccc2c(c1)C1c3ccccc3C2c2ncncc21

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.38
ATM Q13315 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CYP2A6 P11509 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
SCHEMBL20061786 0.91 CYP2A6 (0.33) EGFRADRA1DADRA1AALDH1A1CYP3A4
SCHEMBL20061807 0.91 CYP2A6 (0.33) EGFRADRA1DADRA1AALDH1A1CYP3A4
SCHEMBL20061789 0.89 KDM4E (0.40) EGFRKDM4EALDH1A1PKMHPGD
SCHEMBL20061797 0.89 CYP2A6 (0.34) EGFRMEN1KMT2AADRA1DADRA1A
SCHEMBL20061811 0.87 CYP2A6 (0.33) EGFRMEN1KMT2AADRA1DADRA1A
SCHEMBL20061804 0.84 EGFR (0.35) EGFRKDM4E
SCHEMBL20061795 0.84 EGFR (0.32) EGFRKDM4E
SCHEMBL20061791 0.81 MAPK9 (0.37) EGFRKDM4EALDH1A1MAPTPKM
SCHEMBL20061818 0.81 MAPK9 (0.37) EGFRKDM4EALDH1A1MAPTPKM
SCHEMBL20061806 0.78 KDM4E (0.37) EGFRATMKDM4EALDH1A1TP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11239432-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2022-02-01 US disclosed
US-20180108848-A1 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-04-19 US disclosed
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 (2 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-11239432-B2 Organic electroluminescent materials and devices OCIAD1, OSBP, OCIAD2 EGFR 3000/4885ATM 4631/4885KDM4E 4450/4885
US-20180108848-A1 Organic electroluminescent materials and devices OSBP, OSBP2, OCIAD2 EGFR 4403/4885ATM 4413/4885KDM4E 4668/4885

“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.