Sugi Predict

Sugi Predict / Compounds / SCHEMBL4201889

SCHEMBL4201889

SCHEMBL4201889

N#Cc1cccc(C(=O)c2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.63
▸ TDP1 Q9NUW8 1/20 0.63
▸ L3MBTL1 Q9Y468 1/20 0.63
▸ VNN1 O95497 11/20 0.59
▸ GSK3B P49841 2/20 0.59
▸ ALDH1A1 P00352 1/20 0.54
▸ PBRM1 Q86U86 1/20 0.53
▸ PTGS1 P23219 1/20 0.52
▸ PTGS2 P35354 1/20 0.52
▸ CLK1 P49759 1/20 0.51
▸ DYRK1A Q13627 1/20 0.51
▸ DYRK1B Q9Y463 1/20 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
SCHEMBL6832704 0.89 GSK3B (0.56) ATMTDP1L3MBTL1VNN1GSK3B
Benzophenone SCHEMBL9307169 0.88 ALDH1A1 (0.64) ATMTDP1L3MBTL1VNN1GSK3B
SCHEMBL7273846 0.87 CLK1 (0.58) ATMTDP1L3MBTL1VNN1GSK3B
SCHEMBL9856491 0.87 GSK3B (0.54) ATMTDP1L3MBTL1VNN1GSK3B
SCHEMBL6651723 0.86 GSK3B (0.53) ATMTDP1L3MBTL1VNN1GSK3B
SCHEMBL9797519 0.86 GSK3B (0.53) ATMTDP1L3MBTL1VNN1GSK3B
SCHEMBL11445310 0.86 VNN1 (0.61) ATMTDP1L3MBTL1VNN1GSK3B
SCHEMBL15209661 0.85 GSK3B (0.59) ATMVNN1GSK3BALDH1A1
SCHEMBL29441888 0.84 GSK3B (0.62) GSK3B
SCHEMBL60691 0.84 GSK3B (0.62) GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-55143926-A — — None — — JP disclosed
EP-3162799-B1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2021-03-10 — — EP disclosed
US-10696640-B2 Fluoroalkylating agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2020-06-30 — — US disclosed
CN-110590798-A Process for producing cyclobutanetetracarboxylic acid derivative 日产化学工业株式会社 2019-12-20 — — CN disclosed
CN-110105367-A The manufacturing method of cyclobutane tetracarboxylic acid derivatives 日产化学工业株式会社 2019-08-09 — — CN disclosed
US-20190233380-A1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-08-01 — — US disclosed
CN-105916865-B Process for producing cyclobutanetetracarboxylic acid derivative 日产化学工业株式会社 2019-06-25 — — CN disclosed
US-10308613-B2 Fluoroalkylating agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-06-04 — — US disclosed
CN-105916866-B Process for producing cyclobutanetetracarboxylic acid derivative 日产化学工业株式会社 2018-08-28 — — CN disclosed
US-20170197920-A1 FLUOROALKYLATING AGENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2017-07-13 — — US disclosed
CN-101189214-A Substituted 4, 5-dihydro-1, 2, 4-triazin-6-ones, 1, 2, 4-triazin-6-ones and their use as fungicides DOW AGROSCIENCES LLC (US) 2008-05-28 — — CN disclosed
EP-1881966-A2 SUBSTITUTED 4,5-DIHYDRO-1,2,4-TRIAZIN-6-ONES, 1,2,4-TRIANZIN-6-ONES, AND THEIR USE AS FUNGICIDES Dow AgroSciences LLC (US) 2008-01-30 — — EP disclosed
WO-2007113294-A1 PROCESS FOR SYNTHESIZING ORGANOELEMENTAL COMPOUNDS LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) 2007-10-11 — — WO disclosed
EP-1840651-A1 Positive resist composition and pattern formation method using the same FUJIFILM Corporation (JP) 2007-10-03 — — EP disclosed
US-20070194468-A1 Method of preparing organomagnesium compounds LUDWIG-MAXIMILIANS-UNIVERSITAT MUNCHEN (DE) 2007-08-23 — — US disclosed
WO-2006119400-A2 SUBSTITUTED 4,5-DIHYDRO-1,2,4-TRIAZIN-6-ONES, 1,2,4-TRIANZIN-6-ONES, AND THEIR USE AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2006-11-09 — — WO disclosed
US-20060252755-A1 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones, and their use as fungicides DOW AGROSCIENCES LLC 2006-11-09 — — US disclosed
JP-S55143926-A PREPARATION OF 3-BENZOYLBENZALDEHYDE NISSAN CHEM IND LTD 1980-11-10 — — JP disclosed
US-4192890-A Novel benzoylphenylacetic acid esters ROUSSEL UCLAF (FR) 1980-03-11 — — US disclosed
US-4184874-A Photosensitive composition containing chelate compound FUJI PHOTO FILM CO., LTD. (JP) 1980-01-22 — — 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-10308613-B2 Fluoroalkylating agent AFF1, AFF4, AFF2 ATM 2573/4885TDP1 3030/4885L3MBTL1 1520/4885
US-20060252755-A1 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones, and their use as fungicides DDT, CYP4B1, CYP4X1 ATM 4593/4885TDP1 1473/4885L3MBTL1 2800/4885
US-20070194468-A1 Method of preparing organomagnesium compounds SCLY, LIG3, LIG4 ATM 4133/4885TDP1 3273/4885L3MBTL1 1294/4885
US-10696640-B2 Fluoroalkylating agent AFF1, AFF4, AFF2 ATM 2573/4885TDP1 3030/4885L3MBTL1 1520/4885
US-20190233380-A1 FLUOROALKYLATING AGENT AFF1, AFF4, AFF2 ATM 2573/4885TDP1 3030/4885L3MBTL1 1520/4885
US-20170197920-A1 FLUOROALKYLATING AGENT AFF1, AFF4, AFF2 ATM 2573/4885TDP1 3030/4885L3MBTL1 1520/4885

“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.