SCHEMBL2557587

SCHEMBL2557587

Nc1c(B(O)O)cc(F)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL29460057 1.00 ALDH1A1 (0.31) ALDH1A1LMNACES2CES1
SCHEMBL2993734 0.80 CES2 (0.33) CES2CES1
SCHEMBL30502469 0.80 CES2 (0.33) CES2CES1
SCHEMBL30952527 0.76 CA1 (0.40) ALDH1A1LMNACES2CES1
SCHEMBL1032872 0.76 CA1 (0.40) ALDH1A1LMNACES2CES1
SCHEMBL5347272 0.76 CA2 (0.32) CES2CES1
SCHEMBL20296440 0.74 ALDH1A1 (0.31) ALDH1A1CES2CES1
SCHEMBL29517741 0.74 ALDH1A1 (0.31) ALDH1A1CES2CES1
SCHEMBL29956433 0.74 ALDH1A1 (0.34) ALDH1A1CES2CES1
SCHEMBL28824845 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12195473-B2 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD (CN) 2025-01-14 US disclosed
CN-115192577-B KRAS mutein inhibitors 北京加科思新药研发有限公司 2024-03-29 CN disclosed
US-11787811-B2 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-10-17 US disclosed
US-20230011726-A1 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO LTD (CN) 2023-01-12 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-115192577-A KRAS mutein inhibitors 北京加科思新药研发有限公司 2022-10-18 CN disclosed
US-11384087-B1 2022-07-12 US disclosed
US-20220213109-A1 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO LTD (CN) 2022-07-07 US disclosed
CN-113651814-B KRAS mutein inhibitors 北京加科思新药研发有限公司 2022-06-17 CN disclosed
CN-114349750-A KRAS mutein inhibitors 北京加科思新药研发有限公司 2022-04-15 CN disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
US-11180506-B2 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD (CN) 2021-11-23 US disclosed
CN-113651814-A KRAS mutein inhibitors 北京加科思新药研发有限公司 2021-11-16 CN disclosed
CN-113454083-A KRAS mutein inhibitors 北京加科思新药研发有限公司 2021-09-28 CN disclosed
US-20210292331-A1 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD (CN) 2021-09-23 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 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 (7 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-20230011726-A1 KRAS mutant protein inhibitors KRAS, NRAS, APC ALDH1A1 3978/4885LMNA 3922/4885CES2 4863/4885
US-12195473-B2 KRAS mutant protein inhibitors KRAS, NRAS, APC ALDH1A1 3978/4885LMNA 3922/4885CES2 4863/4885
US-11180506-B2 KRAS mutant protein inhibitors KRAS, NRAS, APC ALDH1A1 3978/4885LMNA 3922/4885CES2 4863/4885
US-11384087-B1 KRAS, NRAS, APC ALDH1A1 3682/4885LMNA 4247/4885CES2 4821/4885
US-11787811-B2 KRAS mutant protein inhibitors KRAS, NRAS, APC ALDH1A1 3978/4885LMNA 3922/4885CES2 4863/4885
US-20220213109-A1 KRAS mutant protein inhibitors KRAS, NRAS, APC ALDH1A1 3978/4885LMNA 3922/4885CES2 4863/4885
US-20210292331-A1 KRAS mutant protein inhibitors KRAS, NRAS, APC ALDH1A1 3978/4885LMNA 3922/4885CES2 4863/4885

“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.