SCHEMBL41190

SCHEMBL41190

[CH](c1ccccn1)c1ccccn1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.74
MEN1 O00255 2/20 0.74
NPC1 O15118 2/20 0.74
KMT2A Q03164 2/20 0.74
ATM Q13315 1/20 0.74
NR4A1 P22736 1/20 0.54
MAOA P21397 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
GRM4 Q14833 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
CCR1 P32246 1/20 0.48
CCR5 P51681 1/20 0.48
CCR8 P51685 1/20 0.48
METAP1 P53582 1/20 0.48
BLM P54132 1/20 0.48
HIF1A Q16665 1/20 0.48
DOHH Q9BU89 1/20 0.48

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
SCHEMBL229329 0.85 NPC1 (1.00) RAB9AMEN1NPC1KMT2AATM
SCHEMBL31560044 0.85 NPC1 (1.00) RAB9AMEN1NPC1KMT2AATM
SCHEMBL9394256 0.85 NPC1 (1.00) RAB9AMEN1NPC1KMT2AATM
SCHEMBL229328 0.85 NPC1 (1.00) RAB9AMEN1NPC1KMT2AATM
SCHEMBL427375 0.85 NPC1 (0.61) RAB9AMEN1NPC1KMT2AATM
SCHEMBL721181 0.80 MEN1 (0.79) RAB9AMEN1NPC1KMT2AATM
Methyl Alcohol SCHEMBL28478479 0.80 NPC1 (0.89) RAB9AMEN1NPC1KMT2AATM
SCHEMBL721182 0.80 MEN1 (0.79) RAB9AMEN1NPC1KMT2AATM
SCHEMBL15535704 0.79 NPC1 (0.48) RAB9AMEN1NPC1KMT2AATM
SCHEMBL22684051 0.79 NPC1 (0.48) RAB9AMEN1NPC1KMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3606528-B1 TRICYCLIC COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 (GSK3) INHIBITORS AND USES THEREOF BROAD INST INC (US) 2023-10-18 EP claimed
CN-108558932-B Bis (2-pyridyl) methyl-substituted aminophenoxy magnesium complex and preparation method and application thereof 华东理工大学 2022-10-25 CN claimed
EP-3172213-B1 MACROCYCLIC KINASE INHIBITORS AND USES THEREOF DANA FARBER CANCER INST INC (US) 2021-09-22 EP claimed
CN-111362838-A Urea group-containing diimine palladium catalyst, ligand thereof and application thereof in olefin polymerization 中国科学技术大学 2020-07-03 CN claimed
US-9493469-B2 Piperidine inhibitors of Janus kinase 3 AUSPEX PHARMACEUTICALS, INC. (US) 2016-11-15 US claimed
EP-2177522-B1 NOVEL CARBAPENEM DERIVATIVES XUANZHU PHARMA CO LTD (CN) 2013-09-04 EP claimed
US-20080300232-A1 N-Piperidine Derivatives as Ccr3 Modulators ASTRAZENECA AB (SE) 2008-12-04 US claimed
EP-1730136-A1 N-PIPERIDINE DERIVATES AS CCR3 MODULATORS AstraZeneca AB (SE) 2006-12-13 EP claimed
WO-2005090330-A1 N-PIPERIDINE DERIVATES AS CCR3 MODULATORS ASTRAZENECA AB (SE) 2005-09-29 WO claimed
EP-1311513-B1 CATALYSTS BOREALIS TECH OY (FI) 2004-10-06 EP claimed
EP-0707564-B1 DIFLUORO STATONE ANALOGS MERRELL PHARMA INC (US) 2000-09-20 EP claimed
EP-0276825-B1 4 (3H)-QUINAZOLINONE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS NISSHIN FLOUR MILLING CO., LTD. (JP) 1992-09-09 EP claimed
US-5008266-A Antiulcer agent NISSHIN FLOUR MILLING CO., LTD. (JP) 1991-04-16 US claimed
EP-0276825-A1 4 (3H)-Quinazolinone derivatives, processes for their preparation and pharmaceutical compositions NISSHIN FLOUR MILLING CO., LTD. (JP) 1988-08-03 EP claimed
WO-2024145435-A2 LIPID COMPOSITIONS AND METHODS FOR DELIVERY TO IMMUNE CELLS Life Technologies Corporation (US) 2024-07-04 WO disclosed
US-11999757-B2 Synthesis of boronate ester derivatives and uses thereof MELINTA SUBSIDIARY CORP. (US) 2024-06-04 US disclosed
CN-111556872-B Synthesis of borate derivatives and uses thereof 梅琳塔治疗公司 2024-05-10 CN disclosed
WO-1988002750-A1 1,4-DIHYDROPYRIDINE BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1988-04-21 WO disclosed
EP-0205511-A1 NEW PIPERAZINE DERIVATIVES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1986-12-30 EP disclosed
WO-1986003748-A1 NEW PIPERAZINE DERIVATIVES BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT M (DE) 1986-07-03 WO 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 (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-11999757-B2 Synthesis of boronate ester derivatives and uses thereof ADH5, ADH1A, ADH7 RAB9A 3139/4885MEN1 3249/4885NPC1 1287/4885
US-20080300232-A1 N-Piperidine Derivatives as Ccr3 Modulators CCR3, CCR1, CCR4 RAB9A 790/4885MEN1 4343/4885NPC1 135/4885

“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.