SCHEMBL993779

SCHEMBL993779

CCCNC(=O)C(F)(F)F

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.69
ALDH1A1 P00352 2/20 0.65
POLB P06746 2/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
CA3 P07451 2/20 0.56
CA5A P35218 2/20 0.56
CA5B Q9Y2D0 2/20 0.56
CA14 Q9ULX7 2/20 0.56
CA2 P00918 2/20 0.56
CA12 O43570 1/20 0.56
CA4 P22748 1/20 0.56
CA6 P23280 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
MMP9 P14780 1/20 0.43

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
SCHEMBL2736707 0.86 EPHX1 (0.84) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL1389225 0.84 EPHX1 (0.96) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL13861685 0.84 ALDH1A1 (0.79) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL7539898 0.83 CA3 (0.78) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL5988047 0.83 EPHX1 (0.50) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL10690536 0.82 EPHX1 (1.00) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL7716931 0.82 EPHX1 (1.00) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL10688529 0.82 EPHX1 (1.00) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL13010044 0.82 EPHX1 (1.00) EPHX1ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL10683800 0.82 EPHX1 (1.00) EPHX1ALDH1A1POLBSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2197879-B1 C7-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS INC (US) 2014-01-22 EP claimed
EP-2197879-A1 C7-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS, INC. (US) 2010-06-23 EP claimed
US-7687496-B2 C7-substituted camptothecin analogs BIONUMERIK PHARMACEUTICALS, INC. (US) 2010-03-30 US claimed
WO-2009051580-A1 C7-SUBSTITUTED CAMPTOTHECIN ANALOGS BIONUMERIK PHARMACEUTICALS, INC. (US) 2009-04-23 WO claimed
US-20090099224-A1 C7- substituted camptothecin analogs BIONUMERIK PHARMACEUTICALS, INC. 2009-04-16 US claimed
CN-118165071-A Oxo-spiro indoline compound and preparation method and application thereof 深圳信立泰药业股份有限公司 2024-06-11 CN disclosed
CN-118084996-A Reversible termination nucleotide and application thereof in DNA synthesis sequencing and single molecule sequencing 上海交通大学 2024-05-28 CN disclosed
CN-112236423-B Piperidinyl-3- (aryloxy) propanamides and propionic acid esters 武田药品工业株式会社 2024-02-06 CN disclosed
US-20230387464-A1 Nonaqueous Electrolytic Solution and Nonaqueous Electrolytic Solution Battery MU IONIC SOLUTIONS CORPORATION (JP) 2023-11-30 US disclosed
US-20230387464-A1 Nonaqueous Electrolytic Solution and Nonaqueous Electrolytic Solution Battery MU IONIC SOLUTIONS CORPORATION (JP) 2023-11-30 US disclosed
CN-116390917-A MRGX2 antagonists 葛兰素史密斯克莱知识产权发展有限公司 2023-07-04 CN disclosed
WO-2023083194-A1 WEE1 PROTEIN KINASE DEGRADATION AGENT AND USE THEREOF 杭州格博生物医药有限公司 2023-05-19 WO disclosed
EP-0773026-A2 NK-1 receptor antagonists for the treatment of cancer PFIZER INC. (US) 1997-05-14 EP disclosed
US-5569662-A ANTIINFLAMMATORY AGENT, GASTROINTESTINAL DISORDERS, NERVOUS SYSTEM DISORDERS, ANTIASTHMA AGENTS, ANALGESICS PFIZER INC. (US) 1996-10-29 US disclosed
US-5449602-A Polynucleotides AMOCO CORPORATION (US) 1995-09-12 US disclosed
EP-0324616-B1 Template-directed photoligation AMOCO CORP (US) 1995-03-29 EP disclosed
EP-0324616-A2 Template-directed photoligation AMOCO CORPORATION (US) 1989-07-19 EP disclosed
US-4719312-A FLUOROALKYLAMINES MERCK & CO., INC. (US) 1988-01-12 US disclosed
EP-0009944-B1 LYSOSOMOTROPIC FLUORINATED AMINE THERAPEUTIC AGENTS AND COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1983-05-18 EP disclosed
EP-0009944-A2 Lysosomotropic fluorinated amine therapeutic agents and compositions containing them MERCK & CO. INC. (US) 1980-04-16 EP 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 (1 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-20090099224-A1 C7- substituted camptothecin analogs ABCB1, ABCC1, ABCG2 EPHX1 2043/4885ALDH1A1 979/4885POLB 1624/4885

“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.