SCHEMBL47068

SCHEMBL47068

COC(=O)c1cccc(C=O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.61
UNG P13051 1/20 0.61
P4HB P07237 3/20 0.57
GRIN2D O15399 1/20 0.57
GRIN3B O60391 1/20 0.57
GRIN1 Q05586 1/20 0.57
GRIN2A Q12879 1/20 0.57
GRIN2B Q13224 1/20 0.57
GRIN2C Q14957 1/20 0.57
GRIN3A Q8TCU5 1/20 0.57
ERN1 O75460 3/20 0.55
HCRTR1 O43613 1/20 0.55
HCRTR2 O43614 1/20 0.55
TSHR P16473 1/20 0.53
LOXL2 Q9Y4K0 1/20 0.53
CYP4F2 P78329 1/20 0.51
CYP4A11 Q02928 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
POLB P06746 2/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL29677467 1.00 ALDH1A1 (0.61) ALDH1A1UNGP4HBGRIN2DGRIN3B
3-Formylbenzoic Acid SCHEMBL6558253 0.93 UNG (0.74) ALDH1A1UNGP4HBGRIN2DGRIN3B
SCHEMBL31013334 0.90 ERN1 (0.65) ALDH1A1UNGP4HBGRIN2DGRIN3B
SCHEMBL5861135 0.90 ERN1 (0.65) ALDH1A1UNGP4HBGRIN2DGRIN3B
SCHEMBL18546896 0.89 ALDH1A1 (0.51) ALDH1A1UNGP4HBGRIN2DGRIN3B
SCHEMBL29903423 0.88 ALDH1A1 (0.49) ALDH1A1UNGP4HBGRIN2DGRIN3B
SCHEMBL4955281 0.87 L3MBTL1 (0.53) ALDH1A1UNGP4HBGRIN2DGRIN3B
SCHEMBL4407110 0.87 P4HB (0.68) ALDH1A1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL11456160 0.87 P4HB (0.59) ALDH1A1P4HBGRIN2DGRIN3BGRIN1
SCHEMBL11222093 0.87 P4HB (0.68) ALDH1A1P4HBGRIN2DGRIN3BGRIN1

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 1401 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117296850-B Medicine for repelling or fumigating tobacco nails and application thereof 浙江大学 2025-04-25 CN claimed
CN-114920667-B Electrochemical preparation method of atta Lu Lunzhi 湖南大学 2024-06-21 CN claimed
CN-117683038-A Preparation method of tetraphenylporphyrin compound 中国石化扬子石油化工有限公司 2024-03-12 CN claimed
CN-117617252-A Application of 3-formaldehyde methyl benzoate in prevention and treatment of tobacco beetles 福建中烟工业有限责任公司 2024-03-01 CN claimed
CN-117296850-A Medicine for repelling or fumigating tobacco nails and application thereof 浙江大学 2023-12-29 CN claimed
CN-114920667-A Electrochemical preparation method of astraglucol 湖南大学 2022-08-19 CN claimed
CN-113480764-B Preparation method of enhanced polyvinyl alcohol antibacterial film and product thereof 贵州省材料产业技术研究院 2021-12-24 CN claimed
CN-113480764-A Preparation method of enhanced polyvinyl alcohol antibacterial film and product thereof 贵州省材料产业技术研究院 2021-10-08 CN claimed
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
US-20030092634-A1 Novel compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. 2003-05-15 US claimed
US-6506733-B1 Which process comprises hydrogenating a compound of Formula 9: presence of a catalytic amount of 20% palladium hydroxide on carbon. AXYS PHARMACEUTICALS, INC. 2003-01-14 US claimed
US-6458168-B1 Hair dyeing method using an aliphatic cationic amine and compound chosen from an aldehyde, a ketone, a quinone, a di-imino-isoindoline, and a 3-aminoisoindolone derivative L'OREAL S.A. (FR) 2002-10-01 US claimed
US-6451067-B1 HAIR DYE MIXTURE L'OREAL S.A. (FR) 2002-09-17 US claimed
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 US claimed
EP-1159260-A1 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2001-12-05 EP claimed
WO-2000055124-A2 NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2000-09-21 WO claimed
EP-1001943-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM Aventis Pharma S.A. (FR) 2000-05-24 EP claimed
WO-1999003843-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-01-28 WO claimed
WO-1991018861-A1 2-(HYDROXYMETHYL) ACRYLATE DERIVATIVES AND PROCESS FOR THEIR PREPARATION COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1991-12-12 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 ALDH1A1 83/4885UNG 2513/4885P4HB 715/4885
US-20030092634-A1 Novel compounds and compositions as protease inhibitors SERPINB1, HPN, CTRL ALDH1A1 3641/4885UNG 1146/4885P4HB 199/4885

“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.