SCHEMBL5690876

SCHEMBL5690876

CC(C)(C)C(=O)NC(=O)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
PKM P14618 1/20 0.48
PTK2B Q14289 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 7/20 0.39
ALOX12 P18054 4/20 0.39
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 5/20 0.36
RAB9A P51151 3/20 0.36
RECQL P46063 1/20 0.36
GAA P10253 2/20 0.35
NPC1 O15118 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MAPT P10636 2/20 0.34
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.33
AGTR1 P30556 1/20 0.33

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
SCHEMBL12572603 0.86 CYP1A2 (0.44) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL22454078 0.83 CYP1A2 (0.43) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL1138743 0.83 EPHX1 (0.44) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL31066656 0.81 CYP1A2 (0.41) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL3648521 0.81 CRBN (0.48) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL14997672 0.81 RIPK1 (0.41) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL13713522 0.78 CYP1A2 (0.40) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL20970392 0.78 CYP1A2 (0.40) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL6970957 0.78 CYP1A2 (0.40) CYP1A2PKMPTK2BL3MBTL1ALDH1A1
SCHEMBL14191707 0.78 CYP1A2 (0.40) CYP1A2PKMPTK2BL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119894533-A Methods and compositions for activating, modulating and regulating weight loss and therapeutic uses thereof 科吉恩治疗股份有限公司 2025-04-25 CN disclosed
US-20240294491-A1 SALT OF HETEROCYCLIC COMPOUND WITH ANTI-MALARIA ACTIVITY, AND CRYSTALS THEREOF EISAI R&D MANAGEMENT CO., LTD. (JP) 2024-09-05 US disclosed
EP-4342889-A1 SALT OF HETEROCYCLIC COMPOUND WITH ANTI-MALARIA ACTIVITY, AND CRYSTALS THEREOF Eisai R&D Management Co., Ltd. (JP) 2024-03-27 EP disclosed
US-11858940-B2 Selective modulators of mutant LRRK2 proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2024-01-02 US disclosed
CN-108028428-B Non-aqueous fluoride salts, solutions and uses thereof 加州理工学院 2022-02-18 CN disclosed
US-11066416-B2 Rapafucin derivative compounds and methods of use thereof THE JOHNS HOPKINS UNIVERSITY (US) 2021-07-20 US disclosed
WO-2020031796-A1 LUBRICATION METHOD JXTGエネルギー株式会社 2020-02-13 WO disclosed
US-20200040004-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RAPAFUSYN PHARMACEUTICALS, INC. 2020-02-06 US disclosed
EP-3239238-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE CONTAINING SAME Mitsubishi Gas Chemical Company, Inc. (JP) 2017-11-01 EP disclosed
EP-2067821-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2009-06-10 EP disclosed
US-20040053923-A1 Novel isoindole derivatives BANYU PHARMACEUTICAL CO., LTD. 2004-03-18 US disclosed
US-20030194646-A1 Mono-, di-, and triazaporphyrin compounds optionally in the form of a metal or metalloid complex MITSUI CHEMICALS, INC. (JP) 2003-10-16 US disclosed
US-6627288-B1 Optical recording medium and porphycene compound MITSUI CHEMICALS, INC. (JP) 2003-09-30 US disclosed
US-6608098-B1 Diabetes or obesity, 2-(4-(3-isopropyl-2,5-dioxo-2,3-dihydro-1H-pyrrolo(2,1-a) isoindol-9(5H)-yl)phenoxy)-N-propylacetamide BANYU PHARMACEUTICAL CO., LTD. (JP) 2003-08-19 US disclosed
US-20030091931-A1 Benzbisazole compound and optical recording medium containing the compound MITSUI CHEMICALS, INC. (JP) 2003-05-15 US disclosed
EP-1262966-A2 Optical recording medium and novel azaporphyrin compound Mitsui Chemicals, Inc. (JP) 2002-12-04 EP disclosed
EP-1247655-A1 OPTICAL RECORDING MEDIUM AND NOVEL AZAPORPHYRIN COMPOUNDS Mitsui Chemicals, Inc. (JP) 2002-10-09 EP disclosed
EP-1245571-A1 BENZBISAZOLE COMPOUND AND OPTICAL RECORDING MEDIUM CONTAINING THE COMPOUND Mitsui Chemicals, Inc. (JP) 2002-10-02 EP disclosed
EP-1207161-A1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-05-22 EP disclosed
EP-1180765-A1 Optical recording medium and porphycene compound Mitsui Chemicals, Inc. (JP) 2002-02-20 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 (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-11066416-B2 Rapafucin derivative compounds and methods of use thereof RICTOR, FKBP14, MTOR CYP1A2 4052/4885PKM 4395/4885PTK2B 1883/4885
US-20200040004-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR CYP1A2 4052/4885PKM 4395/4885PTK2B 1883/4885
US-20240294491-A1 SALT OF HETEROCYCLIC COMPOUND WITH ANTI-MALARIA ACTIVITY, AND CRYSTALS THEREOF REN, RCC1, LSS CYP1A2 1411/4885PKM 1961/4885PTK2B 3495/4885
US-20030091931-A1 Benzbisazole compound and optical recording medium containing the compound DAO, CACNA1I, KCNB2 CYP1A2 308/4885PKM 1951/4885PTK2B 894/4885
US-11858940-B2 Selective modulators of mutant LRRK2 proteolysis and associated methods of use LRRK2, ADRM1, CRBN CYP1A2 4779/4885PKM 2397/4885PTK2B 993/4885
US-20040053923-A1 Novel isoindole derivatives GPR119, SLC5A2, SLC5A1 CYP1A2 68/4885PKM 2376/4885PTK2B 1859/4885

“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.