SCHEMBL277948

SCHEMBL277948

CC(=O)c1nccnc1C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45
ALDH1A1 P00352 4/20 0.44
MAPT P10636 4/20 0.37
KDM4E B2RXH2 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
CYP3A4 P08684 2/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
BLM P54132 1/20 0.37
AGER Q15109 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
KMT2A Q03164 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
DYRK1A Q13627 1/20 0.36

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
SCHEMBL9630721 0.89 KDM4E (0.48) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL13544700 0.87 ADORA3 (0.41) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL13697278 0.87 PDE3B (0.39) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL10202036 0.87 PDE3B (0.39) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL29364216 0.87 SMN1; SMN2 (0.39) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL335305 0.87 SMN1; SMN2 (0.39) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL23602966 0.84 PDE3B (0.38) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL31716840 0.84 ALDH1A1 (0.40) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL3701660 0.84 PDE3B (0.38) PDE3BPDE3AALDH1A1MAPTKDM4E
SCHEMBL29434463 0.84 PDE3B (0.38) PDE3BPDE3AALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104643004-A Purple yam essence, and preparation method and application thereof SHANGHAI INST TECHNOLOGY 2015-05-27 CN claimed
EP-3781661-B1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC (US) 2024-03-13 EP disclosed
US-11525106-B2 Tetraacetyldiamine and triacetyldiamine derivatives useful as bleach activators DOW GLOBAL TECHNOLOGIES LLC (US) 2022-12-13 US disclosed
US-20210155877-A1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC 2021-05-27 US disclosed
EP-2572243-B1 POLYMERIZABLE COMPOSITION FUJIFILM CORP (JP) 2021-04-07 EP disclosed
WO-2021046921-A1 FLAVOR COMPOSITION AND E-LIQUID CONTAINING FLAVOR COMPOSITION 深圳雾芯科技有限公司 2021-03-18 WO disclosed
EP-3781661-A1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS Dow Global Technologies, LLC (US) 2021-02-24 EP disclosed
WO-2019204184-A1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-10-24 WO disclosed
EP-2598946-B1 POLYMERIZABLE COMPOSITION FUJIFILM CORP (JP) 2019-04-03 EP disclosed
US-20180163022-A1 NEAR INFRARED ABSORBING CURABLE COMPOSITION, CURED FILM, SOLID IMAGE PICKUP ELEMENT, INFRARED ABSORBER, AND COMPOUND FUJIFILM CORPORATION (JP) 2018-06-14 US disclosed
EP-0949540-A1 Method for producing lithographic printing plate suitable for laser scan exposure, and photopolymerizable composition FUJI PHOTO FILM CO., LTD (JP) 1999-10-13 EP disclosed
WO-1995000040-A1 STABILISING VOLATILE FLAVOURINGS FIRMENICH SA (CH) 1995-01-05 WO disclosed
US-5069992-A POLYURETHANE CONTAINING CARBOXYL GROUPS FUJI PHOTO FILM CO., LTD. (JP) 1991-12-03 US disclosed
US-4955399-A Smoking article R. J. REYNOLDS TOBACCO COMPANY (US) 1990-09-11 US disclosed
EP-0371285-A2 Smoking article R.J. REYNOLDS TOBACCO COMPANY (US) 1990-06-06 EP disclosed
EP-0043853-B1 INJECTION MOLDABLE AMIDE-IMIDE POLYMERS CONTAINING DIVALENT ALIPHATIC RADICALS DERIVED FROM ALIPHATIC DIAMINES AMOCO CORPORATION (US) 1985-11-13 EP disclosed
EP-0043853-A4 INJECTION MOLDABLE AMIDE-IMIDE POLYMERS CONTAINING DIVALENT ALIPHATIC RADICALS DERIVED FROM ALIPHATIC DIAMINES. STANDARD OIL CO (US) 1982-05-28 EP disclosed
US-4323493-A Injection moldable amide-imide polymers contaning divalent aliphatic radicals derived from aliphatic diamines STANDARD OIL COMPANY (INDIANA) (US) 1982-04-06 US disclosed
EP-0043853-A1 INJECTION MOLDABLE AMIDE-IMIDE POLYMERS CONTAINING DIVALENT ALIPHATIC RADICALS DERIVED FROM ALIPHATIC DIAMINES. STANDARD OIL CO (US) 1982-01-20 EP disclosed
WO-1981002015-A1 INJECTION MOLDABLE AMIDE-IMIDE POLYMERS CONTAINING DIVALENT ALIPHATIC RADICALS DERIVED FROM ALIPHATIC DIAMINES STANDARD OIL CO (US) 1981-07-23 WO 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-11525106-B2 Tetraacetyldiamine and triacetyldiamine derivatives useful as bleach activators AADAC, DLAT, NAT10 PDE3B 3607/4885PDE3A 3024/4885ALDH1A1 1218/4885
US-20210155877-A1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS AADAC, DLAT, NAT10 PDE3B 3607/4885PDE3A 3024/4885ALDH1A1 1218/4885
US-20180163022-A1 NEAR INFRARED ABSORBING CURABLE COMPOSITION, CURED FILM, SOLID IMAGE PICKUP ELEMENT, INFRARED ABSORBER, AND COMPOUND H1-0, PEAK1, CHRM1 PDE3B 3485/4885PDE3A 2841/4885ALDH1A1 1677/4885

“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.