SCHEMBL19863576

SCHEMBL19863576

CCOC(=O)[C@H]1C[C@H](O)CC[C@@H]1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.40
PTPN1 P18031 1/20 0.40
PPP1CC P36873 1/20 0.40
MAPT P10636 3/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CA12 O43570 4/20 0.35
CA1 P00915 4/20 0.35
CA2 P00918 4/20 0.35
CA9 Q16790 3/20 0.35
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL29595410 1.00 PPM1B (0.40) PPM1BPTPN1PPP1CCMAPTNPC1
SCHEMBL7637402 1.00 PPM1B (0.40) PPM1BPTPN1PPP1CCMAPTNPC1
SCHEMBL23378604 0.89 MAPT (0.43) PPM1BPTPN1PPP1CCMAPTMEN1
SCHEMBL17816963 0.87 PPM1B (0.38) PPM1BPTPN1PPP1CCMAPTNPC1
SCHEMBL17814245 0.87 PPM1B (0.38) PPM1BPTPN1PPP1CCMAPTNPC1
SCHEMBL24335670 0.87 PPM1B (0.38) PPM1BPTPN1PPP1CCMAPTNPC1
SCHEMBL13954427 0.86 PPM1B (0.43) PPM1BPTPN1PPP1CCMAPTNPC1
SCHEMBL29799038 0.85 NPC1 (0.40) PPM1BPTPN1PPP1CCMAPTNPC1
SCHEMBL1935168 0.85 NPC1 (0.40) PPM1BPTPN1PPP1CCMAPTNPC1
SCHEMBL18828250 0.84 TRPM8 (0.47) PPM1BPTPN1PPP1CCMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114394966-B Pyridopyrimidinone CDK2/4/6 inhibitors 辉瑞公司 2024-10-11 CN disclosed
US-20220324872-A1 CDK2/4/6 Inhibitors PFIZER INC. (US) 2022-10-13 US disclosed
US-11396512-B2 CDK2/4/6 inhibitors PFIZER INC. (US) 2022-07-26 US disclosed
US-11396512-B2 CDK2/4/6 inhibitors PFIZER INC. (US) 2022-07-26 US disclosed
US-20200392142-A1 CDK2/4/6 Inhibitors PFIZER INC. (US) 2020-12-17 US disclosed
WO-2018033815-A1 PYRIDOPYRIMDINONE CDK2/4/6 INHIBITORS PFIZER INC. (US) 2018-02-22 WO disclosed
US-20180044344-A1 CDK2/4/6 Inhibitors PFIZER INC. (US) 2018-02-15 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 (4 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-20220324872-A1 CDK2/4/6 Inhibitors CDK2, CDK6, CDK20 PPM1B 228/4885PTPN1 1656/4885PPP1CC 1463/4885
US-20200392142-A1 CDK2/4/6 Inhibitors CDK2, CDK6, CDK20 PPM1B 225/4885PTPN1 1586/4885PPP1CC 1423/4885
US-11396512-B2 CDK2/4/6 inhibitors CDK2, CDK6, CDK20 PPM1B 228/4885PTPN1 1656/4885PPP1CC 1463/4885
US-20180044344-A1 CDK2/4/6 Inhibitors CDK2, CDK6, CDK20 PPM1B 228/4885PTPN1 1656/4885PPP1CC 1463/4885

“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.