SCHEMBL6035175

SCHEMBL6035175

Cn1nc(OCc2ccccc2)cc1C=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.58
MAOA P21397 2/20 0.43
MAOB P27338 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
HRH4 Q9H3N8 1/20 0.40
NUDT1 P36639 1/20 0.39
GRM5 P41594 1/20 0.39
GRM3 Q14832 1/20 0.39
GSTP1 P09211 1/20 0.38
ADORA3 P0DMS8 2/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
MAPT P10636 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38

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
SCHEMBL5120406 0.83 PKM (0.46) PKMMAOAMAOBNPC1RAB9A
SCHEMBL6035432 0.82 PKM (0.52) PKMMEN1KMT2A
SCHEMBL6035428 0.82 PKM (0.52) PKMMEN1KMT2A
SCHEMBL5114932 0.82 PKM (0.45) PKMMAOAMAOBNPC1RAB9A
SCHEMBL5119974 0.81 CNR1 (0.46) PKMMAOAMAOBNPC1RAB9A
SCHEMBL4852255 0.81 PKM (0.43) PKMMAOAMAOBNPC1RAB9A
SCHEMBL5109263 0.80 PKM (0.43) PKMMAOAMAOBNPC1RAB9A
SCHEMBL13860622 0.78 PKM (0.60) PKMMAOAMAOBNPC1RAB9A
SCHEMBL26353196 0.77 PKM (0.59) PKMMAOBNPC1RAB9AMEN1
SCHEMBL17473560 0.77 PKM (0.58) PKMMEN1KMT2ASMN1; SMN2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4116301-A1 FUSED TRICYCLIC COMPOUND AND MEDICINAL USE THEREOF Japan Tobacco Inc. (JP) 2023-01-11 EP disclosed
EP-2980089-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2017-12-20 EP disclosed
US-20170174682-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-06-22 US disclosed
US-9637483-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-05-02 US disclosed
US-20160039811-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-02-11 US disclosed
EP-2980089-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2016-02-03 EP disclosed
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US disclosed
EP-1513817-A1 1, 2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Pharmaceutical Company Limited (JP) 2005-03-16 EP disclosed
WO-2003099793-A9 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2005-02-10 WO disclosed
WO-2003099793-A1 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-12-04 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 (3 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-20170174682-A1 HETEROCYCLIC COMPOUND JAK2, JAK1, STAT3 PKM 967/4885MAOA 4455/4885MAOB 3974/4885
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 PKM 2082/4885MAOA 1304/4885MAOB 954/4885
US-20160039811-A1 HETEROCYCLIC COMPOUND JAK2, JAK1, STAT3 PKM 967/4885MAOA 4455/4885MAOB 3974/4885

“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.