SCHEMBL19736005

SCHEMBL19736005

CCOC(=O)C1=C(O)[C@H](c2ccccc2)NC1=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.52
ALDH1A1 P00352 4/20 0.51
LMNA P02545 1/20 0.51
TSHR P16473 1/20 0.51
TRPC5 Q9UL62 1/20 0.51
ALOX12 P18054 1/20 0.50
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.45
KIF11 P52732 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL29009182 0.72 CA12 (0.43) ALDH1A1LMNATSHRKDM4EGAA
SCHEMBL18025267 0.72 KIF11 (0.75) DHFRTSHRKIF11CA1CA2
SCHEMBL19752667 0.72 KIF11 (0.75) DHFRTSHRKIF11CA1CA2
SCHEMBL5347891 0.72 KIF11 (0.75) DHFRTSHRKIF11CA1CA2
SCHEMBL17863914 0.71 DHFR (0.51) DHFRALDH1A1LMNATSHRTRPC5
SCHEMBL17863913 0.71 DHFR (0.51) DHFRALDH1A1LMNATSHRTRPC5
SCHEMBL17863910 0.71 DHFR (0.51) DHFRALDH1A1LMNATSHRTRPC5
SCHEMBL30576343 0.71 DHFR (0.51) DHFRALDH1A1LMNATSHRTRPC5
SCHEMBL27897208 0.71 DHFR (0.57) DHFRALDH1A1LMNATSHRTRPC5
SCHEMBL29009201 0.70 ALDH1A1 (0.49) ALDH1A1KDM4EGAACA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240199609-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2024-06-20 US disclosed
US-11905283-B2 Compounds and compositions for inhibiting the activity of SHP2 NOVARTIS AG (CH) 2024-02-20 US disclosed
CN-114057689-A Compounds and compositions for inhibiting SHP2 activity 诺华股份有限公司 2022-02-18 CN disclosed
CN-109415360-B Compounds and compositions for inhibiting SHP2 activity 诺华股份有限公司 2021-11-02 CN disclosed
US-20210300919-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2021-09-30 US disclosed
US-10934285-B2 Compounds and compositions for inhibiting the activity of SHP2 NOVARTIS AG (CH) 2021-03-02 US disclosed
EP-3468972-B1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2020-05-20 EP disclosed
WO-2017216706-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2017-12-21 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 (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-10934285-B2 Compounds and compositions for inhibiting the activity of SHP2 PTPN1, PTPN2, PTPN5 DHFR 2300/4885ALDH1A1 3978/4885LMNA 4664/4885
US-11905283-B2 Compounds and compositions for inhibiting the activity of SHP2 PTPN1, PTPN2, PTPN5 DHFR 2300/4885ALDH1A1 3978/4885LMNA 4664/4885
US-20240199609-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 PTPN1, PTPN2, PTPN5 DHFR 2300/4885ALDH1A1 3978/4885LMNA 4664/4885
US-20210300919-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 PTPN1, PTPN2, PTPN5 DHFR 2300/4885ALDH1A1 3978/4885LMNA 4664/4885

“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.