SCHEMBL2476705

SCHEMBL2476705

Cc1[nH]c2c(NCc3ccccc3)nc(C(N)=O)cc2c1C

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.50
CYP2C9 P11712 5/20 0.50
CYP2C19 P33261 5/20 0.50
CYP1A2 P05177 4/20 0.50
CYP2D6 P10635 4/20 0.50
EGFR P00533 2/20 0.46
CD38 P28907 1/20 0.44
NPY5R Q15761 1/20 0.43
ACHE P22303 2/20 0.42
APP P05067 1/20 0.42
PIK3CB P42338 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RPS6KB1 P23443 4/20 0.41
AURKA O14965 3/20 0.41
KDR P35968 1/20 0.41

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
SCHEMBL2474375 0.80 CYP3A4 (0.55) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL2473785 0.77 KDM4E (0.38) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL2478366 0.77 CYP3A4 (0.52) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL2473155 0.73 CYP1A2 (0.70) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL1738610 0.72 CYP1A2 (0.68) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL1735914 0.70 MAPT (0.46) APPRPS6KB1AURKA
Hydrochloric Acid SCHEMBL1736968 0.70 MAPT (0.45) APPRPS6KB1AURKA
SCHEMBL18303236 0.69 CD38 (0.41) CD38PIK3CBKDM4EALDH1A1SMN1; SMN2
SCHEMBL18277193 0.68 RPS6KB1 (0.50) CYP3A4CYP2C9CYP2C19CYP1A2CD38
SCHEMBL2475860 0.68 CYP1A2 (0.49) CYP3A4CYP2C9CYP2C19CYP1A2EGFR

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 5 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
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

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 114/4885CYP2C9 391/4885CYP2C19 99/4885
US-20070293532-A1 Pyrrolo [2,3-C] Pyridine Compound, Process for Producing the Same, and Use PGA5, ATP6AP1, PPA1 CYP3A4 114/4885CYP2C9 391/4885CYP2C19 99/4885

“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.