SCHEMBL5507973

SCHEMBL5507973

CNC1CN(C(=O)OC(C)(C)C)CC1Oc1cnc2ccccc2n1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.40
BACE1 P56817 6/20 0.40
ADAM17 P78536 3/20 0.40
BACE2 Q9Y5Z0 2/20 0.40
PDE10A Q9Y233 2/20 0.39
NAMPT P43490 1/20 0.39
MMP3 P08254 1/20 0.38
MMP7 P09237 1/20 0.38
MMP10 P09238 1/20 0.38
MMP8 P22894 1/20 0.38
MMP12 P39900 1/20 0.38
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37

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
SCHEMBL5509582 0.86 USP30 (0.41) USP30PDE10ANAMPTCKS1BSKP1
SCHEMBL5507958 0.83 PDE10A (0.38) USP30PDE10ANAMPTCKS1BSKP1
SCHEMBL5509641 0.82 KDM4E (0.37) USP30PDE10ANAMPTCKS1BSKP1
SCHEMBL5509725 0.81 USP30 (0.44) USP30PDE10ACKS1BSKP1SKP2
SCHEMBL5518832 0.81 USP30 (0.41) USP30BACE1PDE10AMMP3MMP7
SCHEMBL16392572 0.78 PIK3CD (0.52) USP30PDE10A
SCHEMBL4545723 0.78 PIK3CD (0.52) USP30PDE10A
SCHEMBL7814803 0.72 P2RX3 (0.44) PDE10A
SCHEMBL5511933 0.72 P2RX3 (0.44) PDE10A
SCHEMBL20989353 0.72 GPR119 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1838702-A1 PYRROLIDYL DERIVATIVES OF HETEROAROMATIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS Pfizer Products Inc. (US) 2007-10-03 EP disclosed
US-20060183763-A1 Novel pyrrolidyl derivatives of heteroaromatic compounds PFIZER INC 2006-08-17 US disclosed
WO-2006070284-A1 PYRROLIDYL DERIVATIVES OF HETEROAROMATIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS PFIZER PRODUCTS INC. (US) 2006-07-06 WO disclosed
WO-2006070284-A1 PYRROLIDYL DERIVATIVES OF HETEROAROMATIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS PFIZER PRODUCTS INC. (US) 2006-07-06 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-20060183763-A1 Novel pyrrolidyl derivatives of heteroaromatic compounds PDE12, PDE4A, PDE7A USP30 534/4885BACE1 213/4885ADAM17 1692/4885

“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.