SCHEMBL2172974

SCHEMBL2172974

Clc1cnc2cccc(Br)c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.40
AXL P30530 1/20 0.40
KMT2A Q03164 2/20 0.39
BACE1 P56817 1/20 0.39
PDPK1 O15530 1/20 0.38
KDR P35968 1/20 0.37
PTGES O14684 1/20 0.36
PLAU P00749 1/20 0.36
JAK2 O60674 1/20 0.36
KDM4E B2RXH2 2/20 0.35
GPR3 P46089 1/20 0.35
MAPK10 P53779 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
PRNP P04156 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL7148840 0.81 MET (0.45) KMT2APTGESNPC1MET
SCHEMBL1147558 0.80 BACE1 (0.41) NOS1AXLKMT2ABACE1KDR
SCHEMBL4879213 0.80 PDE3B (0.44) NOS1JAK2KDM4EGPR3CYP1A2
SCHEMBL11154668 0.77 NR4A2 (0.55) KMT2AJAK2KDM4ECYP1A2CYP2C9
SCHEMBL29976168 0.77 PDGFRB (0.51) JAK2KDM4EGPR3NPC1
SCHEMBL23360155 0.77 BACE1 (0.39) NOS1AXLKMT2ABACE1KDM4E
SCHEMBL28495811 0.77 BACE1 (0.47) NOS1AXLKMT2ABACE1PLAU
SCHEMBL29923227 0.77 CYP1A2 (0.50) NOS1AXLBACE1KDM4EGPR3
SCHEMBL28523265 0.77 BACE1 (0.39) NOS1AXLBACE1PDPK1KDM4E
SCHEMBL6425923 0.77 CYP1A2 (0.50) NOS1AXLBACE1KDM4EGPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4055014-B1 PYRROLIDINE AND PIPERIDINE COMPOUNDS YUHAN CORP (KR) 2025-04-30 EP disclosed
CN-114867719-B Pyrrolidine and piperidine compounds 柳韩洋行 2024-06-25 CN disclosed
US-11655235-B2 Pyrrolidine and piperidine compounds YUHAN CORPORATION (KR) 2023-05-23 US disclosed
EP-4055014-A1 PYRROLIDINE AND PIPERIDINE COMPOUNDS Yuhan Corporation (KR) 2022-09-14 EP disclosed
CN-114867719-A Pyrrolidine and piperidine compounds 柳韩洋行 2022-08-05 CN disclosed
US-20210147386-A1 PYRROLIDINE AND PIPERIDINE COMPOUNDS YUHAN CORPORATION (KR) 2021-05-20 US disclosed
EP-2346830-B1 GLUCAGON RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK SHARP & DOHME (US) 2015-05-13 EP disclosed
US-8436015-B2 Glucagon receptor antagonist compounds, compositions containing such compounds and methods of use MERCK SHARP & DOHME CORP. (US) 2013-05-07 US disclosed
EP-2346830-A1 GLUCAGON RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE Merck Sharp & Dohme Corp. (US) 2011-07-27 EP disclosed
US-20110172256-A1 GLUCAGON RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK SHARP & DOHME LLC 2011-07-14 US disclosed
WO-2010030722-A1 GLUCAGON RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK SHARP & DOHME CORP. (US) 2010-03-18 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-20110172256-A1 GLUCAGON RECEPTOR ANTAGONIST COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE GCGR, GLP1R, GPR119 NOS1 4772/4885AXL 922/4885KMT2A 4294/4885
US-11655235-B2 Pyrrolidine and piperidine compounds FAP, APC, VHL NOS1 1880/4885AXL 3917/4885KMT2A 2822/4885
US-20210147386-A1 PYRROLIDINE AND PIPERIDINE COMPOUNDS FAP, APC, VHL NOS1 1880/4885AXL 3917/4885KMT2A 2822/4885

“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.