SCHEMBL3224720

SCHEMBL3224720

O=C1Cc2ccc(C(F)(F)F)cc2N1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 2/20 0.66
▸ KIF11 P52732 8/20 0.62
▸ AHR P35869 3/20 0.56
▸ CMA1 P23946 2/20 0.56
▸ EIF2AK2 P19525 1/20 0.54
▸ JUN P05412 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ NFKB2 Q00653 1/20 0.51
▸ RELA Q04206 1/20 0.51
▸ PDK2 Q15119 1/20 0.48
▸ GRM2 Q14416 1/20 0.48
▸ CRBN Q96SW2 1/20 0.47
▸ CCNB2 O95067 1/20 0.46
▸ CDK1 P06493 1/20 0.46
▸ CCNB1 P14635 1/20 0.46
▸ GSK3B P49841 1/20 0.46
▸ CDK5 Q00535 1/20 0.46
▸ CDK5R1 Q15078 1/20 0.46
▸ CCNB3 Q8WWL7 1/20 0.46

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
SCHEMBL30806264 0.86 KIF11 (0.62) TDP2KIF11
SCHEMBL578303 0.86 TDP2 (0.66) TDP2KIF11AHRPDK2
SCHEMBL31492431 0.86 TDP2 (0.66) TDP2KIF11AHRPDK2
SCHEMBL31734651 0.84 TDP2 (0.54) TDP2KIF11JUNNFKB1NFKB2
SCHEMBL10685684 0.83 AHR (0.50) TDP2KIF11AHRCMA1EIF2AK2
SCHEMBL6125101 0.82 AHR (0.56) TDP2KIF11AHRCMA1EIF2AK2
SCHEMBL25424253 0.79 TDP2 (0.58) TDP2KIF11GRM2CCNB2CDK1
SCHEMBL30415799 0.79 TDP2 (0.58) TDP2KIF11GRM2CCNB2CDK1
SCHEMBL18010845 0.79 TDP2 (1.00) TDP2KIF11
SCHEMBL1903306 0.78 KIF11 (0.80) TDP2KIF11AHRGRM2CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070130702-A1 Dyeing process using a specific compound containing active methylene and a compound chosen from a specific aldehyde, a specific ketone, a quinone and a diiminoisoindoline or 3-aminoisoindolone derivative L'OREAL S.A. 2007-06-14 — — US claimed
US-7204857-B1 Dyeing method using a specific active methylene compound and a compound selected among a specific aldehyde, a specific ketone, a quinone and a di-imino-isoindoline or 3-amino-isoindolone derivative L'OREAL S.A. (FR) 2007-04-17 — — US claimed
WO-2023224963-A1 DUAL-ACTING ANGIOTENSIN AND ENDOTHELIN RECEPTOR ANTAGONISTS ARIA PHARMACEUTICALS, INC. (US) 2023-11-23 — — WO disclosed
WO-2023147597-A2 ALLOSTERIC STING MODULATORS AND METHODS OF USE THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-08-03 — — WO disclosed
CN-110240558-A A kind of novel synthesis of Flindokalner raceme 上海华理生物医药股份有限公司 2019-09-17 — — CN disclosed
EP-3191471-A1 4,5-DIHYDROPYRAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2017-07-19 — — EP disclosed
WO-2016038160-A1 4,5-DIHYDROPYRAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2016-03-17 — — WO disclosed
CN-102627649-B Small molecule inhibitors of MDM2 and uses thereof UNIV MICHIGAN 2015-03-25 — — CN disclosed
WO-2013093928-A1 AN IMPROVED PROCESS FOR PREPARING 2-OXINDOLES OF FORMULA I, A KEY RAW MATERIAL FOR MAKING PHARMACEUTICAL DRUGS AND INTERMEDIATES THEREOF ARCH PHARMALABS LIMITED (IN) 2013-06-27 — — WO disclosed
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 — — US disclosed
US-20100063301-A1 SYNTHESIS OF THROMBOPOIETIN ACTIVITY MODULATING COMPOUNDS LIGAND PHARMACEUTICALS INC (US) 2010-03-11 — — US disclosed
EP-0208510-A2 1-Substituted oxindole-3-carboxamines as antiinflammatory and analgesic agents PFIZER INC. (US) 1987-01-14 — — EP disclosed
EP-0175551-A1 Analgesic and antiinflammatory 1,3-diacyl-2-oxindole compounds PFIZER INC. (US) 1986-03-26 — — EP disclosed
US-4569942-A N,3-Disubstituted 2-oxindole-1-carboxamides as analgesic and antiinflammatory agents PFIZER INC. (US) 1986-02-11 — — US disclosed
EP-0164860-A1 N,3-disubstituted 2-oxindole-1-carboxamides as analgesic and antiinflammatory agents PFIZER INC. (US) 1985-12-18 — — EP disclosed
US-4556672-A 3-Substituted 2-oxindole-1-carboxamides as analgesic and anti-inflammatory agents PFIZER INC. (US) 1985-12-03 — — US disclosed
EP-0156603-A2 3-Substituted 2-oxindole-1-carboxamides as analgesic and anti-inflammatory agents PFIZER INC. (US) 1985-10-02 — — EP disclosed
EP-0155828-A2 Process for making 2-oxindole-1-carboxamides and intermediates therefor PFIZER INC. (US) 1985-09-25 — — EP disclosed
EP-0153818-A2 1,3-Disubstituted 2-oxindoles as analgesic and anti-inflammatory agents PFIZER INC. (US) 1985-09-04 — — EP disclosed
US-4160032-A Oxindoles as sleep-inducers SANDOZ, INC. (US) 1979-07-03 — — 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 (3 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-20070130702-A1 Dyeing process using a specific compound containing active methylene and a compound chosen from a specific aldehyde, a specific ketone, a quinone and a diiminoisoindoline or 3-aminoisoindolone derivative KRT18, NDUFB5, NDUFB7 TDP2 3483/4885KIF11 502/4885AHR 1248/4885
US-20100063301-A1 SYNTHESIS OF THROMBOPOIETIN ACTIVITY MODULATING COMPOUNDS MPL, THPO, TBXAS1 TDP2 3797/4885KIF11 4029/4885AHR 3972/4885
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS GPR119, INSR, OAT TDP2 3372/4885KIF11 4334/4885AHR 980/4885

“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.

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