SCHEMBL26423697

SCHEMBL26423697

c1cnc2nc3c(nc2c1)sc1cnccc13

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.38
KDM4E B2RXH2 3/20 0.35
PDK1 Q15118 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
POLB P06746 1/20 0.33
ALDH1A1 P00352 3/20 0.33
HTT P42858 2/20 0.33
NCOA1 Q15788 2/20 0.33
NCOA3 Q9Y6Q9 2/20 0.33
LMNA P02545 1/20 0.33
IDO1 P14902 1/20 0.32
BCHE P06276 2/20 0.31
ACHE P22303 2/20 0.31
FGFR1 P11362 1/20 0.31
FLT1 P17948 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
CASP1 P29466 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
SCHEMBL26423706 0.88 MAPK14 (0.38) MAPK14KDM4EPDK1NPC1RAB9A
SCHEMBL26423667 0.83 NPC1 (0.38) KDM4ENPC1RAB9AALDH1A1HTT
SCHEMBL26423694 0.82 MAPK14 (0.38) MAPK14KDM4EPDK1NPC1RAB9A
SCHEMBL26423699 0.78 LIMK1 (0.41) MAPK14KDM4EPDK1NPC1RAB9A
SCHEMBL26423712 0.75 CYP2A6 (0.33) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL5406439 0.73 LMNA (0.42) KDM4ENPC1ALDH1A1HTTNCOA1
SCHEMBL11884985 0.73 LIMK1 (0.40) KDM4ENPC1RAB9AALDH1A1HTT
SCHEMBL34467237 0.73 LIMK1 (0.40) KDM4ENPC1RAB9AALDH1A1HTT
SCHEMBL26423703 0.72 LIMK1 (0.41) MAPK14KDM4EPDK1NPC1RAB9A
SCHEMBL26423715 0.72 CYP2A6 (0.33) KDM4EALDH1A1HTTNCOA1NCOA3

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 MAPK14 1074/4885KDM4E 2800/4885PDK1 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.