SCHEMBL139880

SCHEMBL139880

CC(C)(C)OC(=O)N1C[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1CO

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.42
SRC P12931 8/20 0.39
ABCB1 P08183 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
ALDH1A1 P00352 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PARP1 P09874 1/20 0.32
USP2 O75604 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL2386707 1.00 NR1H2 (0.42) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL21286125 1.00 NR1H2 (0.42) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL1241324 1.00 NR1H2 (0.42) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL1241323 1.00 NR1H2 (0.42) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL19964151 1.00 NR1H2 (0.42) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL142689 1.00 NR1H2 (0.42) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL20312947 1.00 NR1H2 (0.42) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL1372634 1.00 NR1H2 (0.42) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL30868937 0.97 NR1H2 (0.40) NR1H2SRCABCB1MEN1KMT2A
SCHEMBL6577745 0.92 NR1H2 (0.41) NR1H2SRCMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12459922-B2 PARP7 inhibitors GILEAD SCIENCES, INC. (US) 2025-11-04 US disclosed
EP-3853234-B1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS NIKANG THERAPEUTICS INC (US) 2025-04-23 EP disclosed
US-12264167-B2 Fused tricyclic ring derivatives as SRC homology-2 phosphate inhibitors NIKANG THERAPEUTICS, INC. (US) 2025-04-01 US disclosed
EP-4469448-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2024-12-04 EP disclosed
CN-112996795-B Fused tricyclic derivatives as SRC homo-2 phosphatase inhibitors 尼坎治疗公司 2024-11-12 CN disclosed
CN-113227103-B Trisubstituted heteroaryl derivatives as SRC homo-2 phosphatase inhibitors 尼坎治疗公司 2024-10-01 CN disclosed
CN-113072542-B ROR gamma t inhibitor and preparation method and application thereof 广东东阳光药业股份有限公司 2024-04-05 CN disclosed
US-20240101553-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2024-03-28 US disclosed
US-20230373999-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-11-23 US disclosed
US-20230365529-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2023-11-16 US disclosed
US-20200115389-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS NIKANG THERAPEUTICS, INC. 2020-04-16 US disclosed
WO-2020061103-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2020-03-26 WO disclosed
EP-2889287-B1 DOLASTATIN-10 DERIVATIVE, METHOD OF PRODUCING SAME AND ANTICANCER DRUG COMPOSITION CONTAINING SAME CELLTRION INC (KR) 2016-08-31 EP disclosed
US-9278996-B2 Dolastatin-10 derivative, method of producing the same and anticancer drug composition containing the same CELLTRION, INC. (KR) 2016-03-08 US disclosed
US-20150225455-A1 DOLASTATIN-10 DERIVATIVE, METHOD OF PRODUCING THE SAME AND ANTICANCER DRUG COMPOSITION CONTAINING THE SAME CELLTRION, INC. (KR) 2015-08-13 US disclosed
EP-2889287-A1 DOLASTATIN-10 DERIVATIVE, METHOD OF PRODUCING SAME AND ANTICANCER DRUG COMPOSITION CONTAINING SAME Celltrion, Inc. (KR) 2015-07-01 EP disclosed
US-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS ACHAOGEN, INC. (US) 2012-03-08 US disclosed
US-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER INC (US) 2011-06-16 US disclosed
EP-1905759-A1 N-[1-(3-AMINO-4-PHENYL-BUTYRYL)-4-HYDROXY-PYRROLIDIN-2-YLMETHYL}-PROPIONAMIDE AND RELATED COMPOUNDS AS DPP-IV INHIBITORS FOR THE TREATMENT OFTYPE 2 DIABETES MELLITUS Santhera Pharmaceuticals (Schweiz) AG (CH) 2008-04-02 EP disclosed
WO-2008028662-A1 N-[1-(3-AMINO-4-PHENYL-BUTYRYL)-4-HYDROXY-PYRROLIDIN-2-YLMETHYL}-PROPIONAMIDE AND RELATED COMPOUNDS AS DPP-IV INHIBITORS FOR THE TREATMENT OF TYPE 2 DIABETES MELLITUS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2008-03-13 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 (9 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-20150225455-A1 DOLASTATIN-10 DERIVATIVE, METHOD OF PRODUCING THE SAME AND ANTICANCER DRUG COMPOSITION CONTAINING THE SAME DAD1, DDOST, SCD5 NR1H2 258/4885SRC 3232/4885ABCB1 259/4885
US-20200115389-A1 FUSED TRICYCLIC RING DERIVATIVES AS SRC HOMOLOGY-2 PHOSPHATASE INHIBITORS SRC, PTPRCAP, PTPRC NR1H2 1674/4885SRC 1/4885ABCB1 2588/4885
US-20240101553-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS NR1H2 1539/4885SRC 628/4885ABCB1 797/4885
US-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS RECQL, BLVRB, NQO2 NR1H2 971/4885SRC 4616/4885ABCB1 53/4885
US-12459922-B2 PARP7 inhibitors PARP1, PARP11, PARP2 NR1H2 2769/4885SRC 1461/4885ABCB1 383/4885
US-12264167-B2 Fused tricyclic ring derivatives as SRC homology-2 phosphate inhibitors SRC, PTPRCAP, PTPRC NR1H2 2154/4885SRC 1/4885ABCB1 2553/4885
US-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS CHKA, CSNK1A1, CHKB NR1H2 2872/4885SRC 665/4885ABCB1 564/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 NR1H2 2769/4885SRC 1461/4885ABCB1 383/4885
US-20230373999-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS NR1H2 1539/4885SRC 628/4885ABCB1 797/4885

“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.