SCHEMBL8323643

SCHEMBL8323643

COc1ccccc1N1CCN(C(=O)c2ccc(-c3cnc4[nH]cc(-c5cn[nH]c5)c4c3)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
POLB P06746 3/20 0.58
MAP3K11 Q16584 5/20 0.57
MAP4K1 Q92918 2/20 0.54
SGK1 O00141 3/20 0.52
CAMKK2 Q96RR4 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
KIT P10721 2/20 0.49
IL2 P60568 1/20 0.49
MAPK8 P45983 1/20 0.49
MAPK9 P45984 1/20 0.49
MAPK10 P53779 1/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
NPC1 O15118 1/20 0.49
AXL P30530 3/20 0.48
TNIK Q9UKE5 1/20 0.48

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
SCHEMBL14049334 0.90 MAP3K11 (0.56) MAP3K11MAP4K1SGK1CAMKK2MAPK8
SCHEMBL8322765 0.84 MAP3K11 (0.63) MAP3K11SGK1CAMKK2MAPK8MAPK9
SCHEMBL12829937 0.84 MAP3K11 (0.63) MAP3K11SGK1CAMKK2MAPK8MAPK9
SCHEMBL12829944 0.81 NTRK1 (0.61) MAP3K11MAP4K1SGK1CAMKK2KIT
SCHEMBL21592829 0.78 MAP4K1 (0.56) KMT2AMAP3K11MAP4K1KITIL2
SCHEMBL21592687 0.78 KIT (0.62) MAP3K11MAP4K1KITIL2TNIK
SCHEMBL8313408 0.78 MAP3K11 (0.58) POLBMAP3K11SGK1CAMKK2KIT
SCHEMBL13745551 0.78 CDK8 (0.48) MEN1KMT2APOLBMAP4K1CAMKK2
SCHEMBL13342353 0.77 MAP4K1 (0.55) MAP3K11MAP4K1SGK1CAMKK2KIT
SCHEMBL13342356 0.76 ABL1 (0.57) MAP3K11MAP4K1SGK1CAMKK2KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2295433-A2 JNK inhibitors Eisai R&D Management Co., Ltd. (JP) 2011-03-16 EP disclosed
US-20090215771-A1 JNK INHIBITORS GRACZYK PIOTR 2009-08-27 US disclosed
US-20090215771-A1 JNK INHIBITORS GRACZYK PIOTR 2009-08-27 US disclosed
US-7432375-B2 JNK inhibitors EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-10-07 US disclosed
US-7432375-B2 JNK inhibitors EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-10-07 US disclosed
WO-2004078756-A2 JNK INHIBITORS EISAI CO., LTD. (JP) 2004-09-16 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-20090215771-A1 JNK INHIBITORS MAPKAPK2, MAPK1, MAPKAPK3 MEN1 4830/4885KMT2A 3339/4885POLB 2249/4885

“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.