SCHEMBL8320561

SCHEMBL8320561

Fc1ccccc1-c1cnc2[nH]cc(-c3nccs3)c2c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 3/20 0.49
AXL P30530 4/20 0.48
TNIK Q9UKE5 1/20 0.48
CCNT1 O60563 3/20 0.43
CCNA2 P20248 3/20 0.43
CDK2 P24941 3/20 0.43
CDK9 P50750 3/20 0.43
PIK3CD O00329 1/20 0.43
PIK3R1 P27986 1/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
PIK3CG P48736 1/20 0.43
AR P10275 1/20 0.43
KIT P10721 2/20 0.42
NTRK1 P04629 1/20 0.42
DYRK1A Q13627 1/20 0.41

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
SCHEMBL1798904 0.85 AXL (0.68) CDK8AXLTNIKKITNTRK1
SCHEMBL12763222 0.82 CDK8 (0.47) CDK8AXLTNIKCCNT1CCNA2
SCHEMBL13745373 0.81 CAMKK2 (0.62) CDK8AXLTNIKKIT
SCHEMBL12763221 0.81 CCNT1 (0.48) CDK8AXLTNIKCCNT1CCNA2
SCHEMBL8320044 0.81 CDK8 (0.64) CDK8AXLTNIKCCNT1CCNA2
SCHEMBL1516651 0.80 NTRK1 (0.59) CDK8AXLTNIKCCNT1CCNA2
SCHEMBL8323599 0.79 CDK8 (0.52) CDK8AXLTNIKKITDYRK1A
SCHEMBL8323580 0.77 AXL (0.55) CDK8AXLTNIKCDK2KIT
SCHEMBL12763225 0.76 CCNT1 (0.51) CDK8AXLTNIKCCNT1CCNA2
SCHEMBL8320264 0.76 AXL (0.52) CDK8AXLTNIKKITNTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CDK8 360/4885AXL 3999/4885TNIK 215/4885

“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.