SCHEMBL673163

SCHEMBL673163

c1ccc(-c2nnn[nH]2)nc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.50
NPC1 O15118 8/20 0.50
RAB9A P51151 7/20 0.50
SMN1; SMN2 Q16637 6/20 0.50
METAP1 P53582 5/20 0.50
LMNA P02545 4/20 0.50
L3MBTL1 Q9Y468 4/20 0.50
PKM P14618 3/20 0.50
ALOX15 P16050 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
HSD17B10 Q99714 2/20 0.50
CCR1 P32246 2/20 0.50
CCR5 P51681 2/20 0.50
CCR8 P51685 2/20 0.50
ALPL P05186 2/20 0.50
CYP1A2 P05177 1/20 0.50
POLB P06746 1/20 0.50
BLM P54132 1/20 0.50
HIF1A Q16665 1/20 0.50
DOHH Q9BU89 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
SCHEMBL29415394 1.00 KDM4E (0.50) KDM4ENPC1RAB9ASMN1; SMN2METAP1
SCHEMBL29756476 0.98 NPC1 (0.49) KDM4ENPC1RAB9ASMN1; SMN2METAP1
SCHEMBL27967298 0.98 NPC1 (0.49) KDM4ENPC1RAB9ASMN1; SMN2METAP1
Boric Acid SCHEMBL31103495 0.93 NPC1 (0.45) KDM4ENPC1RAB9ASMN1; SMN2METAP1
SCHEMBL12075237 0.88 KDM4E (0.60) KDM4ENPC1RAB9ASMN1; SMN2METAP1
SCHEMBL13996096 0.85 AURKA (0.49) KDM4ENPC1RAB9ASMN1; SMN2METAP1
SCHEMBL17077596 0.81 CBFB (0.45) KDM4ENPC1RAB9ASMN1; SMN2METAP1
SCHEMBL27936521 0.81 CBFB (0.45) KDM4ENPC1RAB9ASMN1; SMN2METAP1
SCHEMBL29224715 0.81 ACVR1B (0.40) KDM4ENPC1RAB9ASMN1; SMN2METAP1
SCHEMBL29224572 0.80 L3MBTL1 (0.38) KDM4ENPC1RAB9ASMN1; SMN2METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117106189-A Metal organic framework artificial hydrolase and preparation method and application thereof 华南理工大学 2023-11-24 CN claimed
CN-115117371-A Nitrogen-rich monatomic electrocatalyst based on MOF derivation, preparation method and application 安徽理工大学 2022-09-27 CN claimed
CN-109876865-B Preparation and catalytic performance of polyacid-based metal organic framework with intercalation structure 哈尔滨理工大学 2022-03-08 CN claimed
CN-110628421-A Application of pyridine tetrazole tetranuclear copper [ I ] complex in stimulus response luminescent and photochromic material 江西理工大学 2019-12-31 CN claimed
US-9040689-B2 Compounds useful as ligands and particularly as organic chromophores for complexing lanthanides and applications thereof COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2015-05-26 US claimed
CN-104402936-A Iridium complex and preparation method thereof UNIV NINGBO 2015-03-11 CN claimed
CN-104370973-A Iridium complex and preparation method thereof UNIV NINGBO 2015-02-25 CN claimed
CN-104183760-A Organic light-emitting device and manufacturing method thereof OCEANS KING LIGHTING SCIENCE 2014-12-03 CN claimed
CN-104183750-A Organic light-emitting device and manufacturing method thereof OCEANS KING LIGHTING SCIENCE 2014-12-03 CN claimed
CN-104183765-A Organic light emitting diode and preparation method thereof OCEANS KING LIGHTING SCIENCE 2014-12-03 CN claimed
CN-104051650-A Organic electroluminescent device and preparation method thereof OCEANS KING LIGHTING SCIENCE 2014-09-17 CN claimed
CN-103936773-A 1, 4-terephthalic acid-regulated polyazole coordination polymer and preparation method thereof UNIV SHAANXI NORMAL 2014-07-23 CN claimed
CN-103633253-A Blue light organic electroluminescent device and preparation method thereof OCEANS KING LIGHTING SCIENCE 2014-03-12 CN claimed
CN-103633247-A White light organic electroluminescent device and preparation method thereof OCEANS KING LIGHTING SCIENCE 2014-03-12 CN claimed
WO-2013005187-A1 METHOD FOR PREPARING METAL-FREE NITROGEN-CONTAINING CARBON NANOTUBES COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2013-01-10 WO claimed
EP-2543631-A1 Method for preparing metal-free nitrogen-containing carbon nanotubes Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) 2013-01-09 EP claimed
CN-102709483-A Single-layer white organic light emitting device UNIV JILIN 2012-10-03 CN claimed
US-20110112289-A1 COMPOUNDS USEFUL AS LIGANDS AND PARTICULARLY AS ORGANIC CHROMOPHORES FOR COMPLEXING LANTHANIDES AND APPLICATIONS THEREOF COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2011-05-12 US claimed
CN-101492601-A Oxygen sensitive photoluminescence material, method for preparing the same and uses thereof CHANGCHUN INST OPTICS & PRECIS (CN) 2009-07-29 CN claimed
US-4764454-A Color photographic material with color forming ligand compounds and a method of processing FUJI PHOTO FILM CO., LTD. (JP) 1988-08-16 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-20110112289-A1 COMPOUNDS USEFUL AS LIGANDS AND PARTICULARLY AS ORGANIC CHROMOPHORES FOR COMPLEXING LANTHANIDES AND APPLICATIONS THEREOF LAGE3, LOXL1, TBCB KDM4E 2420/4885NPC1 2985/4885RAB9A 2142/4885

“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.