SCHEMBL6003373

SCHEMBL6003373

CCCCC(O[C]=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
SLC7A5 Q01650 1/20 0.38
CTSK P43235 1/20 0.36
CNR2 P34972 1/20 0.36
CASR P41180 1/20 0.36
SLC6A4 P31645 1/20 0.36
NAAA Q02083 2/20 0.36
CA2 P00918 1/20 0.36
CYP3A4 P08684 1/20 0.36
MMP1 P03956 3/20 0.35
MMP7 P09237 3/20 0.35
MMP12 P39900 3/20 0.35
MMP13 P45452 3/20 0.35
ACE P12821 2/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL3928059 0.95 SLC7A5 (0.40) POLBALDH1A1KDM4ESLC7A5CNR2
SCHEMBL6716961 0.93 ALDH1A1 (0.40) POLBALDH1A1SLC7A5CNR2NAAA
SCHEMBL6723179 0.93 ALDH1A1 (0.40) POLBALDH1A1SLC7A5CNR2NAAA
SCHEMBL1432767 0.89 AOC3 (0.39) POLBSLC6A4CYP3A4LMNASMN1; SMN2
SCHEMBL11005234 0.85 HRH3 (0.39) CA2
SCHEMBL27372 0.82 LMNA (0.42) POLBALDH1A1KDM4ESLC7A5SLC6A4
SCHEMBL9572521 0.82 AOC3 (0.43) CASRSLC6A4MMP1MMP7MMP12
SCHEMBL7453749 0.80 POLB (0.44) POLBALDH1A1KDM4ESLC7A5CASR
SCHEMBL3168356 0.79 CYP1A2 (0.36) POLBSLC6A4CYP3A4LMNASMN1; SMN2
SCHEMBL6254117 0.78 POLB (0.42) POLBALDH1A1KDM4ESLC7A5CASR

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210309619-A1 ISOXAZOLIN-5-ONE DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS ACTIVE INGREDIENTS HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 2021-10-07 US disclosed
US-11109593-B2 Isoxazolin-5-one derivative and herbicide containing same as active ingredient HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 2021-09-07 US disclosed
EP-3828176-A1 ISOXAZOLIN-5-ONE DERIVATIVE, AND HERBICIDE CONTAINING SAME AS ACTIVE INGREDIENT Hokko Chemical Industry Co., Ltd. (JP) 2021-06-02 EP disclosed
US-20200267985-A1 ISOXAZOLIN-5-ONE DERIVATIVE AND HERBICIDE CONTAINING SAME AS ACTIVE INGREDIENT HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 2020-08-27 US disclosed
WO-2020022350-A1 ISOXAZOLIN-5-ONE DERIVATIVE, AND HERBICIDE CONTAINING SAME AS ACTIVE INGREDIENT 北興化学工業株式会社 2020-01-30 WO disclosed
CN-110191880-A Isoxazolidin-5-one derivative and herbicide containing the same as active ingredient 北兴化学工业株式会社 2019-08-30 CN disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed
US-6645671-B2 Suppressing reaction between organic solvent and anode via imide compound which coordinates with lithium ions quickly and strongly, improving cycling; power sources for memory retention in electronics FUJITSU LIMITED (JP) 2003-11-11 US disclosed
EP-1158589-A1 SECONDARY LITHIUM BATTERY, NEGATIVE ELECTRODE FOR SECONDARY LITHIUM BATTERY, AND PROCESS FOR PRODUCING THE NEGATIVE ELECTRODE FUJITSU LIMITED (JP) 2001-11-28 EP disclosed
US-20010031396-A1 Lithium secondary battery, anode for lithium secondary battery, and method for manufacturing the anode FUJITSU LIMITED (JP) 2001-10-18 US disclosed
US-5998065-A N-OXYIMIDE ADDITIVE FUJITSU LIMITED (JP) 1999-12-07 US disclosed
EP-0562832-A1 Indole and indazole derivatives, for the treatment and prophylaxis of cerebral disorders, their preparation and their use SANKYO COMPANY LIMITED (JP) 1993-09-29 EP disclosed
US-4539151-A Benzothiazepine derivatives and their method of preparation MITSUI TOATSU CHEMICALS, INC. (JP) 1985-09-03 US disclosed
US-4539150-A HYPOTENSIVE AGENTS, SULFIDING, CYCLIZATION MITSUI TOATSU CHEMICALS, INC. (JP) 1985-09-03 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-20200267985-A1 ISOXAZOLIN-5-ONE DERIVATIVE AND HERBICIDE CONTAINING SAME AS ACTIVE INGREDIENT HAX1, CYP4X1, CANX POLB 4398/4885ALDH1A1 852/4885KDM4E 2850/4885
US-11109593-B2 Isoxazolin-5-one derivative and herbicide containing same as active ingredient HAX1, CYP4X1, CANX POLB 4398/4885ALDH1A1 852/4885KDM4E 2850/4885
US-20210309619-A1 ISOXAZOLIN-5-ONE DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS ACTIVE INGREDIENTS HAX1, CYP4X1, CNPY2 POLB 3724/4885ALDH1A1 795/4885KDM4E 3492/4885

“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.