SCHEMBL16992177

SCHEMBL16992177

COC(=O)c1ccc(CC2CCN(C(=O)OC(C)(C)C)CC2)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.47
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
TGFBR1 P36897 2/20 0.47
ALDH1A1 P00352 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPK14 Q16539 1/20 0.46
PDE4A P27815 2/20 0.46
PDE4B Q07343 2/20 0.46
PDE4C Q08493 2/20 0.46
PDE4D Q08499 2/20 0.46
EED O75530 1/20 0.45
RBBP4 Q09028 1/20 0.45
SUZ12 Q15022 1/20 0.45
EZH2 Q15910 1/20 0.45
AEBP2 Q6ZN18 1/20 0.45
EPHX2 P34913 1/20 0.44
DNMT3A Q9Y6K1 1/20 0.43
YAP1 P46937 1/20 0.43

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
SCHEMBL18310148 0.90 CYP2C9 (0.47) STSKDM4EPKMTGFBR1ALDH1A1
SCHEMBL20140685 0.86 EED (0.48) KDM4EPKMTGFBR1ALDH1A1CYP2C9
SCHEMBL16992294 0.85 MAPK14 (0.53) KDM4EALDH1A1CYP2C9CYP2C19MAPK14
SCHEMBL16992003 0.85 PDE4A (0.44) STSKDM4EPKMTGFBR1ALDH1A1
SCHEMBL16992050 0.83 TGFBR1 (0.50) KDM4EPKMTGFBR1ALDH1A1GPR119
SCHEMBL7472533 0.83 PARP15 (0.52) STSTGFBR1ALDH1A1EPHX2GPR119
SCHEMBL5213121 0.83 TLR7 (0.51) STSKDM4EPKMTGFBR1ALDH1A1
SCHEMBL28662739 0.83 FAAH (0.49) KDM4EALDH1A1MEN1KMT2A
SCHEMBL30606449 0.82 PDE4B (0.47) STSTGFBR1ALDH1A1PDE4APDE4B
SCHEMBL17002527 0.82 PDE4B (0.47) STSTGFBR1ALDH1A1PDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11786524-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (GB) 2023-10-17 US disclosed
US-11786524-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (GB) 2023-10-17 US disclosed
US-20210275525-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2021-09-09 US disclosed
US-20210275525-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2021-09-09 US disclosed
EP-3811944-A1 PHARMACEUTICAL COMPOUNDS AS CHK1 INHIBITORS Sentinel Oncology Limited (GB) 2021-04-28 EP disclosed
US-10973817-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (GB) 2021-04-13 US disclosed
EP-3104860-B1 PHARMACEUTICAL COMPOUNDS AS CHK1 INHIBITORS SENTINEL ONCOLOGY LTD (GB) 2020-12-30 EP disclosed
US-20180271860-A1 PHARMACEUTICAL COMPOUNDS CASCADIAN THERAPEUTICS, INC. (US) 2018-09-27 US disclosed
US-10010547-B2 Pharmaceutical compounds CASCADIAN THERAPEUTICS, INC. (US) 2018-07-03 US disclosed
US-10010547-B2 Pharmaceutical compounds CASCADIAN THERAPEUTICS, INC. (US) 2018-07-03 US disclosed
EP-3104860-A1 PHARMACEUTICAL COMPOUNDS Cascadian Therapeutics, Inc. (US) 2016-12-21 EP disclosed
US-20160361310-A1 PHARMACEUTICAL COMPOUNDS SEATTLE GENETICS, INC. 2016-12-15 US disclosed
WO-2015120390-A1 PHARMACEUTICAL COMPOUNDS ONCOTHYREON INC. (US) 2015-08-13 WO disclosed
WO-2015120390-A1 PHARMACEUTICAL COMPOUNDS ONCOTHYREON INC. (US) 2015-08-13 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 (6 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-10010547-B2 Pharmaceutical compounds CHKA, CHKB, TNK2 STS 4531/4885KDM4E 1351/4885PKM 397/4885
US-20180271860-A1 PHARMACEUTICAL COMPOUNDS CHKA, CHKB, TNK2 STS 4531/4885KDM4E 1351/4885PKM 397/4885
US-11786524-B2 Pharmaceutical compounds CHKA, CHKB, TNK2 STS 4531/4885KDM4E 1351/4885PKM 397/4885
US-20160361310-A1 PHARMACEUTICAL COMPOUNDS CHKA, CHKB, TNK2 STS 4531/4885KDM4E 1351/4885PKM 397/4885
US-20210275525-A1 PHARMACEUTICAL COMPOUNDS CHKA, CHKB, TNK2 STS 4531/4885KDM4E 1351/4885PKM 397/4885
US-10973817-B2 Pharmaceutical compounds CHKA, CHKB, TNK2 STS 4531/4885KDM4E 1351/4885PKM 397/4885

“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.