SCHEMBL24236289

SCHEMBL24236289

CC1(C)c2cc(N(c3ccccc3)c3ccc(-c4ccccc4)cc3)ccc2-c2cc3ccc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)cc3cc21

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PSMB5 P28074 2/20 0.32
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
RARG P13631 1/20 0.32
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
PTGS2 P35354 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
SCHEMBL24236184 0.99 PDK2 (0.34) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL23598214 0.96 PDK2 (0.38) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL23597991 0.95 PDK2 (0.37) PDK2PSMB5RARARARBRARG
SCHEMBL24236271 0.95 PDK2 (0.36) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL16801978 0.95 PDK2 (0.33) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL24236272 0.95 RARA (0.36) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL24255513 0.95 PDK2 (0.36) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL18353785 0.95 PDK2 (0.38) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL16139457 0.94 PDK2 (0.34) PDK2KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL19197155 0.94 PDK2 (0.36) PDK2PSMB5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220140247-A1 PLURALITY OF HOST MATERIALS, COMPOSITION COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2022-05-05 US disclosed
US-20220037596-A1 PLURALITY OF LIGHT-EMITTING MATERIALS, ORGANIC ELECTROLUMINESCENT COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2022-02-03 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-20220037596-A1 PLURALITY OF LIGHT-EMITTING MATERIALS, ORGANIC ELECTROLUMINESCENT COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ELAVL1, EML4, NECTIN4 PDK2 1625/4885KDM4E 3028/4885ALDH1A1 325/4885

“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.