SCHEMBL23288331

SCHEMBL23288331

CC1(C)c2ccccc2-c2c(Nc3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cccc21

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
OPRK1 P41145 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.36
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
PGR P06401 1/20 0.31
MAPK13 O15264 1/20 0.30
MAPK12 P53778 1/20 0.30
MAPK11 Q15759 1/20 0.30
MAPK14 Q16539 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
SCHEMBL18468778 0.95 PDK2 (0.37) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL18468892 0.93 MEN1 (0.40) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL22823769 0.92 PDK2 (0.37) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL20871510 0.91 MEN1 (0.38) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL31282229 0.91 MEN1 (0.38) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL20871535 0.91 MAPT (0.43) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL31282449 0.91 MAPT (0.43) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL17854635 0.91 MEN1 (0.41) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL22000735 0.90 MEN1 (0.41) PDK2MEN1KMT2AKDM4ELMNA
SCHEMBL17081261 0.90 MEN1 (0.41) PDK2MEN1KMT2AKDM4ELMNA

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-20220127251-A1 PROCESS FOR THE PRODUCTION OF ARYLAMINES MERCK PATENT GMBH (DE) 2022-04-28 US disclosed
WO-2021080280-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 엘티소재주식회사 2021-04-29 WO 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-20220127251-A1 PROCESS FOR THE PRODUCTION OF ARYLAMINES MAOB, TYR, INMT PDK2 805/4885MEN1 2585/4885KMT2A 134/4885

“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.