SCHEMBL133403

SCHEMBL133403

O=C1NC(=O)c2c(Nc3ccc(F)cc3)cccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.64
SRC P12931 4/20 0.64
PRKD3 O94806 3/20 0.64
PRKCG P05129 3/20 0.64
PRKCB P05771 3/20 0.64
PRKCA P17252 3/20 0.64
PRKCH P24723 3/20 0.64
PRKCI P41743 3/20 0.64
PRKCE Q02156 3/20 0.64
PRKCQ Q04759 3/20 0.64
PRKCZ Q05513 3/20 0.64
PRKCD Q05655 3/20 0.64
PRKD1 Q15139 3/20 0.64
MAPT P10636 3/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
CASP3 P42574 4/20 0.52
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 4/20 0.51

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
SCHEMBL11878949 0.86 KDM4E (0.53) EGFRSRCPRKD3PRKCGPRKCB
SCHEMBL3259553 0.85 KDM4E (0.64) EGFRSRCPRKD3PRKCGPRKCB
SCHEMBL9566607 0.84 KDM4E (0.51) EGFRSRCPRKD3PRKCGPRKCB
SCHEMBL9566625 0.84 KDM4E (0.51) EGFRSRCPRKD3PRKCGPRKCB
SCHEMBL9657357 0.84 EGFR (0.64) EGFRSRCPRKD3PRKCGPRKCB
Hydrochloric Acid SCHEMBL5138495 0.84 KDM4E (0.62) EGFRSRCPRKD3PRKCGPRKCB
SCHEMBL17685237 0.81 EGFR (0.64) EGFRSRCPRKD3PRKCGPRKCB
SCHEMBL5821140 0.81 EGFR (0.64) EGFRSRCMAPTMEN1KMT2A
Cgp-53353 SCHEMBL230492 0.78 EGFR (1.00) EGFRSRCPRKD3PRKCGPRKCB
Cgp-53353 SCHEMBL29766901 0.78 EGFR (1.00) EGFRSRCPRKD3PRKCGPRKCB

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 1137 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114514019-A Method for producing pharmaceutical preparations containing crystalline and amorphous fractions of active substances 拜耳股份有限公司 2022-05-17 CN claimed
WO-2005037259-A2 METHODS AND COMPOSITIONS FOR THE PREVENTION OR TREATMENT OF NEOPLASIA COMPRISING A COX-2 INHIBITOR IN COMBINATION WITH AN EPIDERMAL GROWTH FACTOR RECEPTOR ANTAGONIST PHARMACIA CORPORATION (US) 2005-04-28 WO claimed
US-20040127470-A1 Methods and compositions for the prevention or treatment of neoplasia comprising a Cox-2 inhibitor in combination with an epidermal growth factor receptor antagonist PHARMACIA CORPORATION (US) 2004-07-01 US claimed
US-20030086924-A1 Treatment with anti-ErbB2 antibodies GENENTECH, INC. 2003-05-08 US claimed
CN-1102643-A Substituted derivatives of diaminophthalimide CIBA GEIGY AG (CH) 1995-05-17 CN claimed
CN-1067052-A The diaminophthalimides and the analogue thereof that replace CIBA GEIGY AG (CH) 1992-12-16 CN claimed
CN-111936487-B Compounds for the treatment of kinase dependent disorders 埃克塞里艾克西斯公司 2024-07-09 CN disclosed
US-12030946-B2 Therapeutic and diagnostic methods for cancer HOFFMANN-LA ROCHE INC. (US) 2024-07-09 US disclosed
CN-118302411-A Therapeutic indazole compounds and methods of use thereof for the treatment of cancer 基因泰克公司 2024-07-05 CN disclosed
CN-112312909-B Compounds for the treatment of kinase dependent disorders 埃克塞里艾克西斯公司 2024-07-02 CN disclosed
CN-118284686-A Systems and methods for cell-based immunotherapy 杭州启函生物科技有限公司 2024-07-02 CN disclosed
US-20240208919-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2024-06-27 US disclosed
US-20240207398-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER GENENTECH INC (US) 2024-06-27 US disclosed
US-6127374-A AN ENZYME INHIBITOR FOR TREATING CANCER, RESTENOSIS, ATHEROSCLEROSIS, ENDOMETRIOSIS AND PSORIASIS WARNER-LAMBERT COMPANY (US) 2000-10-03 US disclosed
WO-2000010588-A9 EPIDERMAL GROWTH FACTOR RECEPTOR ANTAGONISTS FOR TREATING HYPERSECRETION OF MUCUS IN THE LUNGS UNIV CALIFORNIA (US) 2000-08-10 WO disclosed
WO-1999006396-A1 IRREVERSIBLE BICYCLIC INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1999-02-11 WO disclosed
WO-1999006378-A1 IRREVERSIBLE INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1999-02-11 WO disclosed
CN-1128495-A Pharmaceutical formulations of poorly soluble active agents SANDOZ LTD (CH) 1996-08-07 CN disclosed
CN-1102643-A Substituted derivatives of diaminophthalimide CIBA GEIGY AG (CH) 1995-05-17 CN disclosed
CN-1067052-A The diaminophthalimides and the analogue thereof that replace CIBA GEIGY AG (CH) 1992-12-16 CN 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 (2 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-20240208919-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE VHL, NQO1, PCSK9 EGFR 1383/4885SRC 1392/4885PRKD3 1926/4885
US-20040127470-A1 Methods and compositions for the prevention or treatment of neoplasia comprising a Cox-2 inhibitor in combination with an epidermal growth factor receptor antagonist EGFR, PTGFR, ERBB2 EGFR 1/4885SRC 351/4885PRKD3 2064/4885

“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.