SCHEMBL654686

SCHEMBL654686

COC(=O)C1(C)CN(C(=O)OC(C)(C)C)CCC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ESR2 Q92731 1/20 0.39
NR1H2 P55055 3/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
EPHX2 P34913 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP11B2 P19099 1/20 0.36
MAPT P10636 3/20 0.36
ADORA1 P30542 1/20 0.36
PDK4 Q16654 1/20 0.36
USP30 Q70CQ3 1/20 0.35
EPHX1 P07099 1/20 0.35
KDM4E B2RXH2 1/20 0.35
THRB P10828 1/20 0.35
LMNA P02545 1/20 0.35
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
PTPN6 P29350 1/20 0.35

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
SCHEMBL31406695 1.00 USP2 (0.39) USP2SMN1; SMN2ESR2NR1H2DDB1
SCHEMBL5251610 1.00 USP2 (0.39) USP2SMN1; SMN2ESR2NR1H2DDB1
SCHEMBL9269091 0.87 GRM5 (0.36) USP2SMN1; SMN2ALDH1A1
SCHEMBL27743952 0.86 USP2 (0.41) USP2SMN1; SMN2ESR2NR1H2DDB1
SCHEMBL29207289 0.86 USP2 (0.41) USP2SMN1; SMN2ESR2NR1H2DDB1
SCHEMBL18618412 0.85 ADORA1 (0.42) USP2SMN1; SMN2ESR2NR1H2DDB1
SCHEMBL29450194 0.85 ADORA1 (0.42) USP2SMN1; SMN2ESR2NR1H2DDB1
SCHEMBL27143468 0.85 EPHX2 (0.39) USP2SMN1; SMN2ESR2NR1H2DDB1
SCHEMBL31406665 0.83 ESR2 (0.36) USP2SMN1; SMN2ESR2NR1H2DDB1
SCHEMBL31491069 0.83 ESR2 (0.36) USP2SMN1; SMN2ESR2NR1H2DDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260116882-A1 KRAS G12D MODULATING COMPOUNDS GILEAD SCIENCES INC (US) 2026-04-30 US disclosed
US-12448400-B2 KRAS G12D modulating compounds GILEAD SCIENCES, INC. (US) 2025-10-21 US disclosed
EP-4596551-A1 COMPOUNDS WITH ANTI-KRAS MUTANT TUMOR ACTIVITY Trasveda Ltd. (KY) 2025-08-06 EP disclosed
WO-2025108443-A2 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE SWITZERLAND GMBH (CH) 2025-05-30 WO disclosed
US-20250136621-A1 KRAS G12D MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2025-05-01 US disclosed
US-20250109147-A1 KRAS G12D MODULATING COMPOUNDS GILEAD SCIENCES, INC. 2025-04-03 US disclosed
WO-2025059040-A1 MUTANT KRAS MODULATORS AND USES THEREOF NEWAVE PHARMACEUTICAL INC. (US) 2025-03-20 WO disclosed
WO-2025054530-A1 PYRIMIDINE-CONTAINING POLYCYCLIC DERIVATIVES AS KRAS G12D MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2025-03-13 WO disclosed
WO-2025051242-A1 RAS INHIBITOR 泰励生物科技(上海)有限公司 2025-03-13 WO disclosed
CN-119591588-A RAS inhibitors 泰励生物科技(上海)有限公司 2025-03-11 CN disclosed
WO-2003045942-A2 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-06-05 WO disclosed
US-20030100561-A1 Administering 2-amino-N-(1-(3a-benzyl-2-methyl-3-oxo-2,3,3a, 4,6,7-hexahydro-pyrazolo(4,3-c)pyridine-5-carbonyl)-4-phenyl-butyl) -isobutyramide for treating congestive heart failure, obesity CARPINO PHILIP ALBERT (US) 2003-05-29 US disclosed
US-6482825-B2 HEXAHYDRO-PYRAZOLO-(4,3-C)PYRIDINE DERIVATIVES USEFUL FOR INCREASING THE ENDOGENOUS PRODUCTION OR RELEASE OF GROWTH HORMONE IN A HUMAN OR OTHER ANIMAL, THUS TREAT OR PREVENT OSTEOPOROSIS PFIZER INC. 2002-11-19 US disclosed
US-6448263-B1 SYNTHESIS ROUTES FOR SUCH AS 2-AMINO-N-(2-(3A-(R)-BENZYL-2-METHYL-3-OXO-2,3,3A,4,6,7-HEXAHYDRO-PYRAZOLO -(4,3-C) PYRIDIN-5-YL)-1-(R)-BENZYLOXYMETHYL-2-OXO-ETHYL)-ISOBUTYRAMIDE L-TARTARIC ACID SALT PFIZER INC. 2002-09-10 US disclosed
US-20020049196-A1 Growth-hormone secretagogues RAQUALIA PHARMA INC. (JP) 2002-04-25 US disclosed
US-6313140-B1 ADMINISTERING TO A HUMAN OR OTHER ANIMAL PYRAZOLOPYRIMIDINE DERIVATIVE FOR PROPHYLAXIS OR THERAPY OF DISEASE OR CONDITION WHICH MAY BE TREATED OR PREVENTED BY GROWTH HORMONE PFIZER INC. 2001-11-06 US disclosed
US-6306875-B1 ADMINISTERING GROWTH HORMONES DIPEPTIDE COMPOUNDS WHICH ARE GROWTH HORMONE SECRETAGOGUES AND ARE USEFUL FOR THE TREATMENT AND PREVENTION OF OSTEOPOROSIS. PFIZER INC. 2001-10-23 US disclosed
US-6278000-B1 INCREASE LEVEL OF ENDOGENOUS GROWTH HORMONE; USEFUL IN THERAPY AND PROPHYLAXIS OF OSTEOPOROSIS, CONGESTIVE HEART FAILURE, FRAILTY ASSOCIATED WITH AGING AND OBESITY, ACCELERATING BONE FRACTURE REPAIR PFIZER INC. 2001-08-21 US disclosed
US-6110932-A INCREASE THE LEVEL OF ENDOGENOUS GROWTH HORMONE FOR THE TREATMENT AND PREVENTION OF OSTEOPOROSIS, CONGESTIVE HEART FAILURE, FRAILTY ASSOCIATED WITH AGING, OBESITY; ACCELERATING BONE FRACTURE REPAIR, ACCELERATING WOUND HEALING PFIZER INC. (US) 2000-08-29 US disclosed
US-6107306-A OSTEOPOROSIS PFIZER INC. (US) 2000-08-22 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 (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-20030100561-A1 Administering 2-amino-N-(1-(3a-benzyl-2-methyl-3-oxo-2,3,3a, 4,6,7-hexahydro-pyrazolo(4,3-c)pyridine-5-carbonyl)-4-phenyl-butyl) -isobutyramide for treating congestive heart failure, obesity GIPR, GHSR, GPR119 USP2 1366/4885SMN1; SMN2 1144/4885ESR2 644/4885
US-20260116882-A1 KRAS G12D MODULATING COMPOUNDS KRAS, NRAS, HRAS USP2 1804/4885SMN1; SMN2 3109/4885ESR2 3027/4885
US-12448400-B2 KRAS G12D modulating compounds KRAS, NRAS, HRAS USP2 1176/4885SMN1; SMN2 3013/4885ESR2 2324/4885
US-20250136621-A1 KRAS G12D MODULATING COMPOUNDS KRAS, NRAS, HRAS USP2 1176/4885SMN1; SMN2 3013/4885ESR2 2324/4885
US-20250109147-A1 KRAS G12D MODULATING COMPOUNDS KRAS, NRAS, HRAS USP2 1176/4885SMN1; SMN2 3013/4885ESR2 2324/4885
US-20020049196-A1 Growth-hormone secretagogues GHSR, GHRHR, IGFBP6 USP2 3413/4885SMN1; SMN2 1659/4885ESR2 233/4885

“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.