SCHEMBL22326

SCHEMBL22326

c1ccc(N2CCOCC2)nc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.69
KDM4E B2RXH2 3/20 0.69
HPGD P15428 3/20 0.69
HSD17B10 Q99714 3/20 0.69
PLD1 Q13393 1/20 0.61
AR P10275 1/20 0.54
MAPK1 P28482 2/20 0.51
GRIN2D O15399 1/20 0.51
GRIN3B O60391 1/20 0.51
GRIN1 Q05586 1/20 0.51
GRIN2A Q12879 1/20 0.51
GRIN2B Q13224 1/20 0.51
GRIN2C Q14957 1/20 0.51
GRIN3A Q8TCU5 1/20 0.51
MEN1 O00255 1/20 0.51
USP2 O75604 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
TSHR P16473 1/20 0.51

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
SCHEMBL29390734 1.00 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDHSD17B10PLD1
SCHEMBL4354346 0.98 ALDH1A1 (0.67) ALDH1A1KDM4EHPGDHSD17B10PLD1
SCHEMBL30619938 0.89 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10PLD1
SCHEMBL28184430 0.89 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10PLD1
SCHEMBL11059996 0.86 KCNH2 (0.67) ALDH1A1KDM4EHPGDHSD17B10KCNH2
SCHEMBL1124002 0.86 HPGD (0.60) ALDH1A1KDM4EHPGDHSD17B10PLD1
SCHEMBL1123454 0.86 HPGD (0.60) ALDH1A1KDM4EHPGDHSD17B10PLD1
SCHEMBL21353591 0.85
SCHEMBL29857922 0.85 PLD1 (0.73) ALDH1A1KDM4EHPGDHSD17B10PLD1
SCHEMBL15800694 0.85 PLD1 (0.73) ALDH1A1KDM4EHPGDHSD17B10PLD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119080791-A Construction of 1, 3-dioxolane derivatives by catalyzing electron-deficient alkenyl ethylene oxide through Lewis base 山东第一医科大学(山东省医学科学院) 2024-12-06 CN claimed
CN-119059965-A Continuous synthesis method of 4- (pyridine-2-yl) morpholine 深圳智微通科技有限公司 2024-12-03 CN claimed
CN-118904863-A Recycling method of polyester cotton spandex blended fabric 青岛阿脒诺材料技术有限公司 2024-11-08 CN claimed
CN-118893071-A Method for recycling polyester cotton blended fabric 青岛阿脒诺材料技术有限公司 2024-11-05 CN claimed
WO-2023225776-A1 METHOD FOR PREPARING HIGHLY SENSITIVE AND STABLE CHEMILUMINESCENT SUBSTRATE LIQUID AND USE THEREOF IN IMMUNOASSAY 孙嘉怡 2023-11-30 WO claimed
EP-4081299-A1 DIHYDRO-CYCLOPENTA-ISOQUINOLINE DERIVATIVES UCB Biopharma SRL (BE) 2022-11-02 EP claimed
CN-109810806-B Flame-retardant electronic cleaning agent and preparation method thereof 普信氟硅新材料(衢州)有限公司 2021-08-10 CN claimed
CN-112608355-A Preparation method of tetraacetylglucose 北京悦康科创医药科技股份有限公司 2021-04-06 CN claimed
CN-109553591-B Preparation method of quetiapine fumarate intermediate 山东安信制药有限公司 2020-12-15 CN claimed
EP-3728386-A1 METHOD FOR PRODUCING A COMPOSITION COMPRISING A POLYURETHANE WITH NCO END GROUPS BOSTIK SA (FR) 2020-10-28 EP claimed
US-20020077321-A1 Cycloalkyl alkanoic acids as integrin receptor antagonists PHARMACIA CORPORATION 2002-06-20 US claimed
WO-2002018340-A1 GEM-SUBSTITUTED α v β 3 INTEGRIN ANTAGONISTS PHARMACIA CORPORATION (US) 2002-03-07 WO claimed
WO-2001096334-A2 HETEROARYLALKANOIC ACIDS AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA CORPORATION (US) 2001-12-20 WO claimed
WO-2001096307-A2 CYCLOALKYL ALKANOIC ACIDS AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA CORPORATION (US) 2001-12-20 WO claimed
WO-2001096310-A1 DIHYDROSTILBENE ALKANOIC ACID DERIVATIVES USEFUL AS VITRONECTIN ANTAGONISTS PHARMACIA CORPORATION (US) 2001-12-20 WO claimed
EP-0442767-B1 Method and apparatus for treating a natural gas INST FRANCAIS DU PETROLE (FR) 1994-07-20 EP claimed
CN-1041586-A The preparation method of nitro-phenyl-dihydropyridine amides base BAYER AG (DE) 1990-04-25 CN claimed
EP-0138153-B1 A SELECTIVE ACYLATION PROCESS AB LEO (SE) 1988-11-23 EP claimed
US-4592869-A Selective acylation process AKTIEBOLAGET LEO (SE) 1986-06-03 US claimed
EP-0138153-A2 A selective acylation process AB LEO (SE) 1985-04-24 EP 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 (1 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-20020077321-A1 Cycloalkyl alkanoic acids as integrin receptor antagonists ITGA5, ITGB5, ITGB3 ALDH1A1 552/4885KDM4E 3035/4885HPGD 3169/4885

“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.