SCHEMBL3103952

SCHEMBL3103952

Cc1oc(-c2ccc(Cl)nc2)cc1C=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.39
NPC1 O15118 4/20 0.38
RAB9A P51151 3/20 0.38
TERT O14746 3/20 0.37
PIK3CD O00329 1/20 0.37
NOTUM Q6P988 1/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP2A6 P11509 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
PDE10A Q9Y233 1/20 0.34
KCNH2 Q12809 1/20 0.32

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
SCHEMBL3108897 0.85 PIK3CD (0.35) ERN1PIK3CDALDH1A1PDE10A
SCHEMBL3104780 0.82 ERN1 (0.39) ERN1MAPTCYP2A6PDE10A
SCHEMBL3102009 0.81 ERN1 (0.53) ERN1PIK3CDMAPTCYP2A6
SCHEMBL3100220 0.80 NPC1 (0.55) ERN1NPC1RAB9ANOTUMALDH1A1
SCHEMBL3102521 0.79 CYP1A1 (0.44) NPC1RAB9AALDH1A1
SCHEMBL3106911 0.75 CYP3A4 (0.55) ERN1NPC1RAB9AMEN1KMT2A
SCHEMBL3106765 0.75 MKNK1 (0.35) ERN1NPC1RAB9AKCNH2
SCHEMBL3101569 0.73 ESR1 (0.56) ERN1NPC1RAB9AMAPTMEN1
SCHEMBL3102505 0.73 KDM4E (0.50) NPC1RAB9AALDH1A1
SCHEMBL3099337 0.73 ERN1 (0.44) ERN1NPC1RAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2210876-B1 HETEROCYCLIC COMPOUND AS GLUCAGON ANTAGONIST TAKEDA PHARMACEUTICAL (JP) 2015-05-20 EP disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
EP-2210876-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-07-28 EP 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 (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-20100256156-A1 HETEROCYCLIC COMPOUND GLP1R, GPR119, GCGR ERN1 1620/4885NPC1 3994/4885RAB9A 3790/4885

“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.