SCHEMBL2480169

SCHEMBL2480169

CCCn1c(C)c(C)c2ccnc(NCc3ccccc3)c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TMIGD3 P0DMS9 5/20 0.46
ADORA2A P29274 5/20 0.46
ADORA1 P30542 5/20 0.46
ADORA2B P29275 4/20 0.46
PDE4B Q07343 2/20 0.44
UTS2R Q9UKP6 1/20 0.41
ACHE P22303 1/20 0.41
NOS2 P35228 1/20 0.40
HTT P42858 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
EGFR P00533 1/20 0.39
PSMB1 P20618 1/20 0.39
LMNA P02545 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
Hydrochloric Acid SCHEMBL1737704 0.99 MAPK1 (0.46) CYP3A4MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL3846187 0.90 MEN1 (0.40) CYP3A4MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL3843126 0.90 MEN1 (0.45) CYP3A4MAPK1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL1735507 0.89 MEN1 (0.39) CYP3A4MAPK1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL1737814 0.89 KMT2A (0.44) CYP3A4MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL3842521 0.89 CYP1A2 (0.42) CYP3A4MAPK1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL1736944 0.88 CYP1A2 (0.42) CYP3A4MAPK1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL1735357 0.87 POLB (0.44) CYP3A4MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL3846867 0.87 KMT2A (0.46) MEN1KMT2AADORA1PDE4BUTS2R
Hydrochloric Acid SCHEMBL1736775 0.87 LRRK2 (0.45) SMN1; SMN2KMT2AKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1787991-B2 PYRROLO[2,3-c]PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE TAKEDA PHARMACEUTICALS CO (JP) 2020-06-24 EP disclosed
US-20180148446-A1 PYRROLO [2,3-c] PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE TAKEDA PHARMACEUTICALS CO (JP) 2018-05-31 US disclosed
EP-1787991-B1 PYRROLO[2,3-c]PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE TAKEDA PHARMACEUTICAL (JP) 2011-10-05 EP disclosed
EP-1784404-A4 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2009-09-09 EP disclosed
US-20070293532-A1 Pyrrolo [2,3-C] Pyridine Compound, Process for Producing the Same, and Use TAKEDA PHARMACEUTICAL COMPAN6Y LIMITED (JP) 2007-12-20 US disclosed
EP-1787991-A1 PYRROLOÝ2,3-c¨PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2007-05-23 EP disclosed
EP-1784404-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP disclosed
WO-2006025716-A1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-03-09 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-20180148446-A1 PYRROLO [2,3-c] PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE PGA5, ATP6AP1, PPA1 CYP3A4 114/4885MAPK1 1335/4885SMN1; SMN2 3534/4885
US-20070293532-A1 Pyrrolo [2,3-C] Pyridine Compound, Process for Producing the Same, and Use PGA5, ATP6AP1, PPA1 CYP3A4 114/4885MAPK1 1335/4885SMN1; SMN2 3534/4885

“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.