SCHEMBL10062072

SCHEMBL10062072

CC(O)[C@@H](CO)OC(C)n1cnc2c(N)nc(Cl)nc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 3/20 0.46
PDE8A O60658 3/20 0.45
PDE4D Q08499 3/20 0.45
PDE2A O00408 2/20 0.45
KCNH2 Q12809 1/20 0.45
PDE10A Q9Y233 1/20 0.45
CDK2 P24941 2/20 0.42
CCNB1 P14635 1/20 0.42
CCNE1 P24864 1/20 0.42
ADORA3 P0DMS8 9/20 0.41
ADORA2A P29274 4/20 0.41
ADORA1 P30542 3/20 0.41
PDE3A Q14432 2/20 0.40
PNP P00491 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
HSP90AA1 P07900 1/20 0.40

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
SCHEMBL19157558 0.89 PDE8A (0.45) CDK1PDE8APDE4DPDE2AKCNH2
SCHEMBL13981871 0.87 CDK1 (0.49) CDK1PDE8APDE4DPDE2AKCNH2
SCHEMBL20059153 0.84 CDK1 (0.46) CDK1PDE8APDE4DPDE2AKCNH2
SCHEMBL13770668 0.82 ADORA2A (0.56) PDE4DPDE2AADORA2AADORA1LMNA
SCHEMBL24835574 0.78 CDK1 (0.59) CDK1PDE8APDE4DPDE2AKCNH2
SCHEMBL10048814 0.78 BLM (0.38) CDK1CDK2CCNB1CCNE1PDE3A
SCHEMBL15959268 0.77 PDE8A (0.48) CDK1PDE8APDE4DPDE2AKCNH2
SCHEMBL24081983 0.77 CDK2 (0.40) CDK1CDK2CCNB1CCNE1
SCHEMBL10062071 0.76 PDE8A (0.49) CDK1PDE8APDE4DPDE2AKCNH2
SCHEMBL14457638 0.76 PDE8A (0.47) CDK1PDE8APDE4DPDE2AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227433-B2 Use of inhibitors and antisense oligonucleotides of BTK for treating proliferative mastocytosis CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2012-07-24 US disclosed
EP-2404926-A1 Preparation of 2-chloro-9-(2'-deoxy-2'-fluoro-beta-D-arabinofuranosyl)-adenine ScinoPharm Taiwan, Ltd. (TW) 2012-01-11 EP disclosed
US-20100216733-A1 Use of inhibitors and antisense oligonucleotides of btk for treating proliferative mastocytosis UNIVERSITÉ PARIS-SACLAY (FR) 2010-08-26 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-20100216733-A1 Use of inhibitors and antisense oligonucleotides of btk for treating proliferative mastocytosis BTK, LYN, SYK CDK1 253/4885PDE8A 2160/4885PDE4D 688/4885

“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.