SCHEMBL23097306

SCHEMBL23097306

CC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)ccc2-c2cc3ccccc3cc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.35
PTGS2 P35354 1/20 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 0.31
TDP2 O95551 1/20 0.31
LPL P06858 1/20 0.30
LIPG Q9Y5X9 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
SCHEMBL23097279 1.00 PDK2 (0.35) PDK2PTGS2KDM4EALDH1A1CYP1A2
SCHEMBL22662401 1.00 PDK2 (0.35) PDK2PTGS2KDM4EALDH1A1CYP1A2
SCHEMBL24255513 0.99 PDK2 (0.36) PDK2PTGS2KDM4EALDH1A1CYP1A2
SCHEMBL16801986 0.96 PDK2 (0.39) PDK2PTGS2
SCHEMBL16801978 0.96 PDK2 (0.33) PDK2PTGS2KDM4EALDH1A1CYP1A2
SCHEMBL23939975 0.96 PDK2 (0.39) PDK2PTGS2
SCHEMBL24406412 0.96 PDK2 (0.39) PDK2PTGS2KDM4EALDH1A1CYP1A2
SCHEMBL24255794 0.95 PDK2 (0.35) PDK2PTGS2KDM4EALDH1A1CYP1A2
SCHEMBL24236184 0.94 PDK2 (0.34) PDK2PTGS2KDM4EALDH1A1CYP1A2
SCHEMBL24612822 0.94 PDK2 (0.37) PDK2PTGS2

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
EP-3792259-B1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME CHANGCHUN HYPERIONS TECH CO LTD (CN) 2023-11-29 EP disclosed
US-20210078989-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME CHANGCHUN HYPERIONS TECHNOLOGY CO., LTD (CN) 2021-03-18 US disclosed
EP-3792259-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME Changchun Hyperions Technology Co., Ltd. (CN) 2021-03-17 EP 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-20210078989-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME SOX18, TYR, L1CAM PDK2 1382/4885PTGS2 3043/4885KDM4E 148/4885

“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.