SCHEMBL13660485

SCHEMBL13660485

Clc1nccc2c1NC(CNCc1ccccn1)C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.39
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
NPC1 O15118 1/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
PDE7B Q9NP56 1/20 0.35
SCN8A Q9UQD0 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
KDM1A O60341 1/20 0.34

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
SCHEMBL13660482 0.85 HTR2A (0.41) CD274CXCR4
SCHEMBL13660713 0.80 LMNA (0.40) CHRM2ALDH1A1TSHRMEN1KMT2A
SCHEMBL13660480 0.77 NOS3 (0.34)
SCHEMBL13660644 0.73 CYP2D6 (0.39) ALDH1A1TSHRKDM4EHPGDPOLB
SCHEMBL13660484 0.70 ALDH1A1 (0.39) L3MBTL1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL27946219 0.67 HPGD (0.47) CHRM2L3MBTL1ALDH1A1ALOX15TSHR
SCHEMBL29438821 0.66 CHRM2 (0.70) CHRM2L3MBTL1ALDH1A1ALOX15TSHR
SCHEMBL230222 0.66 CHRM2 (0.70) CHRM2L3MBTL1ALDH1A1ALOX15TSHR
SCHEMBL25211342 0.64 CHRM2 (0.68) CHRM2L3MBTL1ALDH1A1ALOX15TSHR
Zinc Ion SCHEMBL30205248 0.64 CHRM2 (0.68) CHRM2L3MBTL1ALDH1A1ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608627-B2 I kappa B kinase inhibition; diabetes; (7-Chloro-1H-pyrrolo[2,3-c]pyridin-2-yl)methanol; N-Benzyl-7-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-27 US disclosed
US-20080064715-A1 6-Azaindole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-13 US 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-20080064715-A1 6-Azaindole Compound RELA, NFKBIA, GPR119 CHRM2 618/4885PDCD1 4096/4885CD274 4465/4885

“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.