SCHEMBL6070286

SCHEMBL6070286

CC(C)CC(=O)Nc1ccc2[nH]c3c(c2c1)CCC(=CN(C)C)C3=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.45
MAPT P10636 6/20 0.45
POLB P06746 2/20 0.45
KDM4E B2RXH2 3/20 0.45
RORC P51449 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TNKS O95271 1/20 0.41
PARP1 P09874 1/20 0.41
PARP15 Q460N3 1/20 0.41
PARP14 Q460N5 1/20 0.41
PARP10 Q53GL7 1/20 0.41
PARP12 Q9H0J9 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
PARP2 Q9UGN5 1/20 0.41
PARP4 Q9UKK3 1/20 0.41
PARP3 Q9Y6F1 1/20 0.41
TERT O14746 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
SCHEMBL6070281 1.00 RAB9A (0.45) RAB9AMAPTPOLBKDM4ERORC
SCHEMBL6071404 0.86 KDM4E (0.48) RAB9AMAPTPOLBKDM4ESMN1; SMN2
SCHEMBL6071402 0.86 KDM4E (0.48) RAB9AMAPTPOLBKDM4ESMN1; SMN2
SCHEMBL6070963 0.79 MAPT (0.45) RAB9AMAPTPOLBKDM4ESMN1; SMN2
SCHEMBL6070960 0.79 MAPT (0.45) RAB9AMAPTPOLBKDM4ESMN1; SMN2
SCHEMBL6070728 0.79 KDM4E (0.57) RAB9AMAPTPOLBKDM4ERORC
SCHEMBL6070536 0.79 RAB9A (0.44) RAB9AMAPTPOLBKDM4ESMN1; SMN2
SCHEMBL6070529 0.79 RAB9A (0.44) RAB9AMAPTPOLBKDM4ESMN1; SMN2
SCHEMBL13925707 0.74 MAPT (0.53) RAB9AMAPTPOLBKDM4ESMN1; SMN2
SCHEMBL6070799 0.74 MAPK10 (0.56) RAB9AMAPTKDM4ERORCSMN1; SMN2

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-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2006-11-23 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-20060264493-A1 Tetracyclic pyrazole derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K1, MAP3K19, MAP3K20 RAB9A 1100/4885MAPT 639/4885POLB 1184/4885

“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.