SCHEMBL6476514

SCHEMBL6476514

CC(C)(C)OC(=O)N1CCN(CCCCF)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TLR8 Q9NR97 1/20 0.45
CHRM2 P08172 2/20 0.44
CHRM1 P11229 2/20 0.44
CHRM4 P08173 1/20 0.44
CHRM3 P20309 1/20 0.44
EPHX2 P34913 6/20 0.43
ACKR3 P25106 4/20 0.43
KMT5A Q9NQR1 1/20 0.41
CNR2 P34972 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
SCHEMBL8253901 0.90 USP2 (0.51) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL6486601 0.90 MEN1 (0.45) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL311100 0.89 CHRM2 (0.50) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL20873847 0.89 USP2 (0.53) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL943825 0.88 TLR8 (0.47) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL18751236 0.86 TLR8 (0.47) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL12264373 0.86 TLR8 (0.47) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL29263655 0.86 TLR8 (0.47) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL12193455 0.86 USP2 (0.47) USP2SMN1; SMN2TLR8CHRM2CHRM1
SCHEMBL8526096 0.86 TLR8 (0.54) USP2SMN1; SMN2TLR8CHRM2CHRM1

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-6962911-B2 Pyrrolopyrimidinone derivatives, process of preparation and use SK CHEMICALS CO., LTD. (KR) 2005-11-08 US disclosed
EP-1257553-B1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK CHEMICALS CO LTD (KR) 2004-05-26 EP disclosed
US-20030171361-A1 Pyrrolopyrimidinone derivatives, process of preparation and use SK CHEMICALS CO., LTD. (KR) 2003-09-11 US disclosed
EP-1257553-A1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK Chemicals Co., Ltd. (KR) 2002-11-20 EP disclosed
WO-2001060825-A1 PYRROLOPYRIMIDINONE DERIVATIVES, PROCESS OF PREPARATION AND USE SK CHEMICALS CO., LTD. (KR) 2001-08-23 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-20030171361-A1 Pyrrolopyrimidinone derivatives, process of preparation and use CYP2C19, DHPS, SDHA USP2 4227/4885SMN1; SMN2 2323/4885TLR8 4297/4885

“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.