SCHEMBL20061789

SCHEMBL20061789

c1ccc2c(c1)C1c3cc4ccccc4cc3C2c2ncncc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
EGFR P00533 3/20 0.39
PDPK1 O15530 1/20 0.35
MAPK9 P45984 1/20 0.34
MAPK10 P53779 1/20 0.34
PLAU P00749 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
NPC1 O15118 2/20 0.32
ALDH1A1 P00352 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
PI4KA P42356 1/20 0.31
PI4K2B Q8TCG2 1/20 0.31
PI4K2A Q9BTU6 1/20 0.31
PI4KB Q9UBF8 1/20 0.31
CYP17A1 P05093 1/20 0.31
CYP19A1 P11511 1/20 0.31

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
SCHEMBL20061818 0.91 MAPK9 (0.37) KDM4EEGFRPDPK1MAPK9MAPK10
SCHEMBL20061791 0.91 MAPK9 (0.37) KDM4EEGFRPDPK1MAPK9MAPK10
SCHEMBL20061784 0.89 EGFR (0.38) KDM4EEGFRCYP2A6ALDH1A1PKM
SCHEMBL20061806 0.89 KDM4E (0.37) KDM4EEGFRPDPK1MAPK9MAPK10
SCHEMBL20061787 0.88 KDM4E (0.36) KDM4EEGFRPDPK1MAPK9MAPK10
SCHEMBL20061804 0.88 EGFR (0.35) KDM4EEGFRPIK3CDPIK3CA
SCHEMBL20061795 0.88 EGFR (0.32) KDM4EEGFR
SCHEMBL20061807 0.81 CYP2A6 (0.33) EGFRCYP1A2CYP2A6ALDH1A1CYP11B2
SCHEMBL20061786 0.81 CYP2A6 (0.33) EGFRCYP1A2CYP2A6ALDH1A1CYP11B2
SCHEMBL20061797 0.79 CYP2A6 (0.34) EGFRCYP1A2CYP2A6NPC1ALDH1A1

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 KDM4E 4450/4885EGFR 3000/4885PDPK1 1539/4885
US-20180108848-A1 Organic electroluminescent materials and devices OSBP, OSBP2, OCIAD2 KDM4E 4668/4885EGFR 4403/4885PDPK1 1700/4885

“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.