SCHEMBL18878956

SCHEMBL18878956

CNc1cnnc2cccnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
MAPT P10636 3/20 0.39
POLB P06746 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
USP2 O75604 1/20 0.39
TGFBR1 P36897 1/20 0.38
HSP90AA1 P07900 2/20 0.34
NPC1 O15118 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
PRMT5 O14744 1/20 0.34
ALOX15 P16050 2/20 0.33
HTT P42858 2/20 0.33
CCR1 P32246 2/20 0.33
CCR5 P51681 2/20 0.33
CCR8 P51685 2/20 0.33
LMNA P02545 2/20 0.33
GMNN O75496 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
SCHEMBL3761764 0.78 MAPT (0.42) KDM4EMAPTPOLBALDH1A1MEN1
SCHEMBL18878943 0.76 MAPT (0.52) KDM4EMAPTPOLBALDH1A1MEN1
SCHEMBL16626083 0.76 PRMT5 (0.49) KDM4EMAPTALDH1A1TGFBR1HSP90AA1
SCHEMBL9058058 0.73 KDM4E (0.50) KDM4EMAPTPOLBALDH1A1MEN1
SCHEMBL18878957 0.72 PRMT5 (0.41) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL18879049 0.72 GPR3 (0.44) KDM4EMAPTALDH1A1TGFBR1NPC1
SCHEMBL30451883 0.72 PRMT5 (0.41) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL3758893 0.72 CCR1 (0.43) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL14310934 0.71 SLC40A1 (0.35) KDM4EMAPTPOLBALDH1A1TGFBR1
SCHEMBL14289097 0.71 TGFBR1 (0.35) KDM4EMAPTALDH1A1TGFBR1HSP90AA1

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-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS EFFECTOR THERAPEUTICS, INC. 2017-05-25 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-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS MAP3K9, MAP3K19, MAP3K20 KDM4E 1316/4885MAPT 2303/4885POLB 1394/4885

“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.