SCHEMBL221980

SCHEMBL221980

O=Cn1nnc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.53
NPC1 O15118 1/20 0.53
SLC9A1 P19634 7/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.50
ATM Q13315 1/20 0.50
KEAP1 Q14145 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
MAPT P10636 1/20 0.50
CYP2C9 P11712 1/20 0.50
THPO P40225 1/20 0.50
CYP4Z1 Q86W10 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
DGAT1 O75907 1/20 0.46
MGAM O43451 2/20 0.44
AMY1A P0DUB6 2/20 0.44
GAA P10253 2/20 0.44

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
SCHEMBL30586926 1.00 RAB9A (0.53) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL7100624 0.79 RAB9A (0.53) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL6008529 0.79 RAB9A (0.53) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL7227104 0.79 SLC9A1 (0.55) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL1568148 0.79 RAB9A (0.53) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL24254311 0.76 RAB9A (0.58) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL19111807 0.76 RAB9A (0.58) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL7659389 0.76 RAB9A (0.58) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL14489533 0.76 RAB9A (0.58) RAB9ANPC1SLC9A1POLBMAPK1
SCHEMBL28979849 0.76 RAB9A (0.54) RAB9ANPC1SLC9A1POLBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118909535-B Yellowing-resistant aging-resistant polyurethane resin coating material and preparation method thereof 福建兴宇树脂有限公司 2024-12-13 CN claimed
CN-118909535-A Yellowing-resistant aging-resistant polyurethane resin coating material and preparation method thereof 福建兴宇树脂有限公司 2024-11-08 CN claimed
CN-113045574-B Process for preparing diazapine derivatives and intermediates therefor 浙江京新药业股份有限公司 2024-06-07 CN claimed
CN-117448064-A Conductive lubricant 甘肃海亮新能源材料有限公司 2024-01-26 CN claimed
CN-116103647-A Novel blackening liquid medicine and preparation method thereof and conductive film blackening method 江苏软讯科技有限公司 2023-05-12 CN claimed
CN-114057724-A BTK inhibitor 鲁南制药集团股份有限公司 2022-02-18 CN claimed
CN-113045574-A Process for preparing diazepine derivative and intermediates thereof 浙江京新药业股份有限公司 2021-06-29 CN claimed
CN-110937987-A Synthetic route of compound and application of compound in field of preparation of antidiabetic drugs 深圳市灵兰生物医药科技有限公司 2020-03-31 CN claimed
EP-2141148-B1 INDOLE DERIVATIVE HAVING CPLA2 INHIBITORY ACTIVITY, USE OF THE SAME AND METHOD FOR PRODUCING THE SAME DAIICHI SANKYO CO LTD (JP) 2013-07-03 EP claimed
US-8293781-B2 Indole derivatives having cPLA2 inhibiting activity and applications and production methods of the same DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-10-23 US claimed
US-20070224919-A1 Iodate-containing chemical-mechanical polishing compositions and methods CABOT MICROELECTRONICS CORPORATION (US) 2007-09-27 US claimed
CN-1125069-C Preparation of alkylthio- and/or arylthio-substd. diketo-diaryl-pyrrolopyrroles CIBA SPACIALTY CHEMICALS HOLDI (CH) 2003-10-22 CN claimed
US-20030069447-A1 Acetal hydroxylamine compounds BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2003-04-10 US claimed
US-20030023023-A1 Hydrolytically degradable polymers and hydrogels made therefrom SHEARWATER CORPORATION 2003-01-30 US claimed
EP-1255727-A1 ACETAL HYDROXYLAMINE COMPOUNDS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2002-11-13 EP claimed
US-6348558-B1 OLIGOMERS COMPRISING ALKYLENE OXIDE MONOMERS AND CARBONATE LINKAGES; POLYCARBONATEETHER COPOLYMERS; DRUG DELIVERY; CONJUGATED TO PEPTIDES OR PROTEINS FOR REDUCED IMMUNOGENICITY; STABILITY SHEARWATER CORPORATION 2002-02-19 US claimed
WO-2001060785-A1 ACETAL HYDROXYLAMINE COMPOUNDS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-08-23 WO claimed
CN-1297450-A Preparation of alkylthio- and/or arylthio-substd. diketo-diaryl-pyrrolopyrroles CIBA SC HOLDING AG (CH) 2001-05-30 CN claimed
US-6187905-B1 PEPTIDE COMPOUND WHICH INHIBITS VIRAL PROTEINASES; VIRICIDES FOR HEPATITIS C, HEPATITIS G, AND HUMAN GB VIRUSES HOFFMANN-LA ROCHE INC. 2001-02-13 US claimed
US-6106599-A Inks XEROX CORPORATION (US) 2000-08-22 US 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-20030069447-A1 Acetal hydroxylamine compounds HRH3, H1-0, HNMT RAB9A 2392/4885NPC1 2802/4885SLC9A1 770/4885

“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.