SCHEMBL26423709

SCHEMBL26423709

c1cnc2sc3nc4nccnc4cc3c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
PDK1 Q15118 1/20 0.37
LIMK1 P53667 3/20 0.36
CYP3A4 P08684 1/20 0.36
IKBKB O14920 1/20 0.36
CHUK O15111 1/20 0.36
CDC7 O00311 1/20 0.36
CLK1 P49759 1/20 0.36
DBF4 Q9UBU7 1/20 0.36
LMNA P02545 3/20 0.35
CYP2A6 P11509 2/20 0.35
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
POLB P06746 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
NR4A2 P43354 1/20 0.33

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
SCHEMBL26423708 0.78 LIMK1 (0.40) KDM4EMAPTPDK1LIMK1CYP3A4
SCHEMBL26423716 0.78 LMNA (0.37) KDM4EMAPTPDK1LIMK1CYP3A4
SCHEMBL26423698 0.77 LIMK1 (0.44) KDM4EMAPTPDK1LIMK1IKBKB
SCHEMBL4903332 0.76 LIMK1 (0.50) KDM4EMAPTPDK1LIMK1IKBKB
SCHEMBL26423567 0.75 ALDH1A1 (0.42) KDM4EMAPTPDK1LIMK1CYP3A4
SCHEMBL26423739 0.74 LIMK1 (0.36) MAPTPDK1LIMK1IKBKBCHUK
SCHEMBL26423730 0.74 LIMK1 (0.36) KDM4EMAPTPDK1LIMK1IKBKB
SCHEMBL26423595 0.72 NPC1 (0.42) KDM4EMAPTPDK1LIMK1CYP3A4
SCHEMBL26423713 0.72 CYP2A6 (0.33) KDM4ECYP2A6ALDH1A1PIK3CA
SCHEMBL26423715 0.72 CYP2A6 (0.33) KDM4ELIMK1CYP2A6ALDH1A1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230127291-A1 HETEROCYCLIC ARYLAMINE COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY PANEL WUHAN TIANMA MICROELECTRONICS CO., LTD. (CN) 2023-04-27 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-20230127291-A1 HETEROCYCLIC ARYLAMINE COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY PANEL OCIAD2, OCIAD1, AZI2 KDM4E 2800/4885MAPT 1685/4885PDK1 4727/4885

“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.