SCHEMBL6071196

SCHEMBL6071196

COc1ccccc1CCC(=O)Nc1ccc2[nH]c3c(ccc4cn[nH]c43)c2c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
MEN1 O00255 1/20 0.57
NPC1 O15118 4/20 0.49
RAB9A P51151 3/20 0.49
HTT P42858 2/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 1/20 0.44
NPY5R Q15761 1/20 0.43
ALDH1A1 P00352 1/20 0.41
CLK2 P49760 1/20 0.41
PRKX P51817 1/20 0.41
CAMK2D Q13557 1/20 0.41
PKN2 Q16513 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
STK17A Q9UEE5 1/20 0.41
MAPT P10636 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
SCHEMBL6071111 0.80 CNR1 (0.46) KMT2AMEN1NPC1NPY5RALDH1A1
SCHEMBL6437573 0.78 KMT2A (0.52) KMT2AMEN1NPC1RAB9AHTT
SCHEMBL6071485 0.77 MAOB (0.56) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL6071631 0.77 MAPK10 (0.52) KMT2AMEN1NPC1RAB9AHTT
SCHEMBL6070591 0.76 CTNNB1 (0.52) KMT2AMEN1NPC1LMNATP53
SCHEMBL6071391 0.73 ROCK2 (0.46) KMT2AMEN1NPC1RAB9AHTT
SCHEMBL6070986 0.72 RAB9A (0.46) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL6071209 0.70 VCP (0.46) NPC1RAB9ASMN1; SMN2POLBCLK2
SCHEMBL6070656 0.69 MAPT (0.48) KMT2AMEN1NPC1RAB9AHTT
SCHEMBL6071127 0.69 NPC1 (0.51) NPC1RAB9ALMNATP53SMN1; 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 KMT2A 2104/4885MEN1 2523/4885NPC1 2842/4885

“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.