SCHEMBL979438

SCHEMBL979438

CC(=O)c1ccc(C(=O)NCC(=O)NCC(F)(F)F)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.44
KMT2A Q03164 3/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 2/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 2/20 0.39
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
RXFP1 Q9HBX9 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
SCHEMBL30593074 1.00 KDM4E (0.44) KDM4EKMT2AATML3MBTL1ALDH1A1
SCHEMBL19540679 0.84 KDM4E (0.41) KDM4EKMT2AATML3MBTL1ALDH1A1
SCHEMBL20988371 0.83 KDM4E (0.42) KDM4EKMT2AATML3MBTL1ALDH1A1
SCHEMBL10068335 0.83 BRD4 (0.47) KDM4EKMT2AMEN1HPGDLMNA
SCHEMBL15741895 0.82 KMT2A (0.51) KDM4EKMT2AATML3MBTL1ALDH1A1
SCHEMBL29370451 0.82 KMT2A (0.51) KDM4EKMT2AATML3MBTL1ALDH1A1
SCHEMBL24994526 0.82 KDM4E (0.39) KDM4EKMT2AATML3MBTL1ALDH1A1
SCHEMBL22877378 0.81 KDM4E (0.41) KDM4EKMT2AATML3MBTL1ALDH1A1
SCHEMBL23528888 0.80 KDM4E (0.40) KDM4EKMT2AATML3MBTL1ALDH1A1
SCHEMBL23528887 0.80 KDM4E (0.40) KDM4EKMT2AATML3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116903488-B Synthesis method of aforana 济南久隆医药科技有限公司 2023-12-15 CN disclosed
CN-116903488-A Synthesis method of aforana 济南久隆医药科技有限公司 2023-10-20 CN disclosed
US-20230303482-A1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE E.I. DU PONT DE NEMOURS AND COMPANY 2023-09-28 US disclosed
US-20230303482-A1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE E.I. DU PONT DE NEMOURS AND COMPANY 2023-09-28 US disclosed
US-20230303482-A1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE E.I. DU PONT DE NEMOURS AND COMPANY 2023-09-28 US disclosed
EP-3150575-B1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE DU PONT (US) 2023-08-09 EP disclosed
EP-3150575-B1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE DU PONT (US) 2023-08-09 EP disclosed
US-11613516-B2 Method for preparing 2-amino-n-(2,2,2-trifluoroethyl) acetamide E. I. DU PONT DE NEMOURS AND COMPANY (US) 2023-03-28 US disclosed
US-11324220-B2 Process for the preparation of isoxazoline compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2022-05-10 US disclosed
CN-113651765-A Synthesis of afurana 江苏君若药业有限公司 2021-11-16 CN disclosed
US-8546618-B2 Method for preparing 3-trifluoromethyl chalcones E.I. DU PONT DE NEMOURS AND COMPANY (US) 2013-10-01 US disclosed
US-8513431-B2 Method for preparing 5-haloalkyl-4, 5-dihydroisoxazole derivatives E.I. DU PONT DE NEMOURS AND COMPANY (US) 2013-08-20 US disclosed
EP-2621894-A1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE E.I. Du Pont De Nemours And Company (US) 2013-08-07 EP disclosed
US-20130165663-A9 METHOD FOR PREPARING 5-HALOALKYL-4, 5-DIHYDROISOXAZOLE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2013-06-27 US disclosed
US-20120277442-A1 METHOD FOR PREPARING 5-HALOALKYL-4, 5-DIHYDROISOXAZOLE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-11-01 US disclosed
US-8217180-B2 Method for preparing 5-haloalkyl-4,5-dihydroisoxazole derivatives E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-07-10 US disclosed
WO-2012047543-A1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-04-12 WO disclosed
WO-2012047543-A1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-04-12 WO disclosed
US-20110009638-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES E.I. DU PONT DE NEMOURS AND COMPANY (DE) 2011-01-13 US disclosed
US-20100249424-A1 METHOD FOR PREPARING 5-HALOALKYL-4,5-DIHYDROISOXAZOLE DERIVATIVES E.I.DUPONT DE NEMOURS AND COMPANY (US) 2010-09-30 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 (7 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-20230303482-A1 METHOD FOR PREPARING 2-AMINO-N-(2,2,2-TRIFLUOROETHYL) ACETAMIDE NAAA, SAT1, NAA15 KDM4E 547/4885KMT2A 266/4885ATM 1315/4885
US-20130165663-A9 METHOD FOR PREPARING 5-HALOALKYL-4, 5-DIHYDROISOXAZOLE DERIVATIVES PRDX2, PRXL2A, PRDX1 KDM4E 2043/4885KMT2A 2294/4885ATM 4809/4885
US-20110009638-A1 METHOD FOR PREPARING 3-TRIFLUOROMETHYL CHALCONES NR3C2, CYP4A11, RAE1 KDM4E 313/4885KMT2A 2428/4885ATM 2932/4885
US-11613516-B2 Method for preparing 2-amino-n-(2,2,2-trifluoroethyl) acetamide NAAA, SAT1, NAA15 KDM4E 507/4885KMT2A 268/4885ATM 1263/4885
US-20100249424-A1 METHOD FOR PREPARING 5-HALOALKYL-4,5-DIHYDROISOXAZOLE DERIVATIVES PRDX2, PRXL2A, PRDX1 KDM4E 2043/4885KMT2A 2294/4885ATM 4809/4885
US-11324220-B2 Process for the preparation of isoxazoline compounds CYP3A7, CYP3A4, CYP3A5 KDM4E 1810/4885KMT2A 1079/4885ATM 3058/4885
US-20120277442-A1 METHOD FOR PREPARING 5-HALOALKYL-4, 5-DIHYDROISOXAZOLE DERIVATIVES PRDX2, PRXL2A, PRDX1 KDM4E 2043/4885KMT2A 2294/4885ATM 4809/4885

“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.