SCHEMBL20875558

SCHEMBL20875558

CSc1ncc2c(=O)n(C3CC3)[nH]c2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 4/20 0.36
PIM2 Q9P1W9 4/20 0.36
TTK P33981 3/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
MAPT P10636 3/20 0.34
HPGD P15428 3/20 0.34
KDM4E B2RXH2 2/20 0.34
THRB P10828 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
JAK2 O60674 5/20 0.32
JAK3 P52333 5/20 0.32
JAK1 P23458 4/20 0.32
PDE9A O76083 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
TYK2 P29597 2/20 0.31
ATM Q13315 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL2881822 0.78 MEN1 (0.39) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL20875336 0.77 MEN1 (0.33) PIM1PIM2TTKMEN1KMT2A
SCHEMBL25216988 0.75 MEN1 (0.35) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL20875403 0.74 MEN1 (0.36) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL1811493 0.74 ALDH1A1 (0.37) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL1812349 0.74 MEN1 (0.36) PIM1PIM2TTKMEN1KMT2A
SCHEMBL12004896 0.73 ADORA3 (0.48) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL20875578 0.72 PDE4A (0.40) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL23126551 0.72 MEN1 (0.33) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL12639225 0.72 ALDH1A1 (0.47) MEN1KMT2AMAPTHPGDKDM4E

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023217201-A2 NOVEL PYRIMIDO-HETEROCYCLIC NOVEL COMPOUND SERVING AS WEE1 INHIBITOR AND APPLICATION THEREOF 杭州德睿智药科技有限公司 2023-11-16 WO disclosed
US-20230118115-A1 SUBSTITUTED PYRAZOLO[3,4-d]PYRIMIDINES AS WEE1 INHIBITORS INTEGRAL BIOSCIENCES PVT. LTD. (IN) 2023-04-20 US disclosed
US-20230118115-A1 SUBSTITUTED PYRAZOLO[3,4-d]PYRIMIDINES AS WEE1 INHIBITORS INTEGRAL BIOSCIENCES PVT. LTD. (IN) 2023-04-20 US disclosed
US-20230109104-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF NUVATION BIO INC (US) 2023-04-06 US disclosed
US-11479555-B2 Substituted 1,2-dihydro-3H-pyrazolo[3,4-D]pyrimidin-3-ones as inhibitors of WEE-1 kinase NEWAVE PHARMACEUTICAL INC. (US) 2022-10-25 US disclosed
US-20220220115-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2022-07-14 US disclosed
US-20220220115-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2022-07-14 US disclosed
US-11332473-B2 Substituted pyrazolo[3,4-d]pyrimidines as Wee1 inhibitors NUVATION BIO INC. (US) 2022-05-17 US disclosed
US-11332473-B2 Substituted pyrazolo[3,4-d]pyrimidines as Wee1 inhibitors NUVATION BIO INC. (US) 2022-05-17 US disclosed
US-11299493-B2 Heterocyclic compounds and uses thereof NUVATION BIO INC. (US) 2022-04-12 US disclosed
US-20200325142-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2020-10-15 US disclosed
WO-2020210380-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF NUVATION BIO INC. (US) 2020-10-15 WO disclosed
WO-2020210375-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF NUVATION BIO INC. (US) 2020-10-15 WO disclosed
US-20200325142-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2020-10-15 US disclosed
EP-3694861-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF Nuvation Bio Inc. (US) 2020-08-19 EP disclosed
WO-2019165204-A1 1,2-DIHYDRO-3H-PYRAZOLO[3,4-D]PYRIMIDINE-3-ONE COMPOUNDS AS INHIBITORS OF WEE-1 KINASE NEWAVE PHARMACEUTICAL INC. (US) 2019-08-29 WO disclosed
WO-2019074979-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF GIRAFPHARMA, LLC (US) 2019-04-18 WO disclosed
WO-2019074979-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF GIRAFPHARMA, LLC (US) 2019-04-18 WO disclosed
US-20190106427-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2019-04-11 US disclosed
US-20190106427-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2019-04-11 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 (8 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-11299493-B2 Heterocyclic compounds and uses thereof WEE1, WEE2, NME1 PIM1 680/4885PIM2 702/4885TTK 724/4885
US-20230118115-A1 SUBSTITUTED PYRAZOLO[3,4-d]PYRIMIDINES AS WEE1 INHIBITORS WEE1, WEE2, DPYD PIM1 963/4885PIM2 1012/4885TTK 430/4885
US-20230109104-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF WEE1, WEE2, NME1 PIM1 680/4885PIM2 702/4885TTK 724/4885
US-20220220115-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF WEE1, WEE2, NME1 PIM1 680/4885PIM2 702/4885TTK 724/4885
US-11479555-B2 Substituted 1,2-dihydro-3H-pyrazolo[3,4-D]pyrimidin-3-ones as inhibitors of WEE-1 kinase WEE1, WEE2, PHKG1 PIM1 505/4885PIM2 508/4885TTK 119/4885
US-20200325142-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF WEE1, WEE2, NME1 PIM1 680/4885PIM2 702/4885TTK 724/4885
US-11332473-B2 Substituted pyrazolo[3,4-d]pyrimidines as Wee1 inhibitors WEE1, WEE2, DPYD PIM1 963/4885PIM2 1012/4885TTK 430/4885
US-20190106427-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF WEE1, WEE2, NME1 PIM1 680/4885PIM2 702/4885TTK 724/4885

“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.