SCHEMBL18608249

SCHEMBL18608249

CC1CCC(NC(=O)c2cnc3n(c2=O)CCS3)CC1

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.80
HPGD P15428 1/20 0.80
KDM4E B2RXH2 2/20 0.71
TSHR P16473 2/20 0.69
RAB9A P51151 7/20 0.57
SMN1; SMN2 Q16637 6/20 0.57
MAPT P10636 3/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
RECQL P46063 1/20 0.57
HSD17B10 Q99714 3/20 0.55
MAPK1 P28482 1/20 0.55
NPC1 O15118 4/20 0.55
TAAR1 Q96RJ0 1/20 0.55
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
HTT P42858 3/20 0.54
LMNA P02545 1/20 0.52

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
SCHEMBL18608252 0.88 ALDH1A1 (0.97) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL18608260 0.86 ALDH1A1 (0.80) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL18608646 0.84 ALDH1A1 (0.73) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL18608542 0.84 ALDH1A1 (0.69) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL18608553 0.81 TSHR (0.67) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL18608638 0.78 ALDH1A1 (0.67) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL13485754 0.78 RAB9A (0.69) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL18608516 0.78 ALDH1A1 (0.64) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL18608349 0.78 ALDH1A1 (0.70) ALDH1A1HPGDKDM4ETSHRRAB9A
SCHEMBL760978 0.76 RAB9A (0.66) ALDH1A1HPGDKDM4ETSHRRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190112316-A1 THIAZOLO[3,2-A] PYRIMIDINONE AND OTHER HETEROBICYCLIC PYRIMIDINONE COMPOUNDS FOR USE IN MEDICAL THERAPY LYSOSOMAL THERAPEUTICS INC (US) 2019-04-18 US disclosed
WO-2017040879-A1 THIAZOLO(3,2-A) PYRIMIDINONE AND OTHER HETEROBICYCLIC PYRIMIDINONE COMPOUNDS FOR USE IN MEDICAL THERAPY LYSOSOMAL THERAPEUTICS INC. (US) 2017-03-09 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-20190112316-A1 THIAZOLO[3,2-A] PYRIMIDINONE AND OTHER HETEROBICYCLIC PYRIMIDINONE COMPOUNDS FOR USE IN MEDICAL THERAPY PARK7, GAA, TYMP ALDH1A1 1351/4885HPGD 542/4885KDM4E 2361/4885

“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.