SCHEMBL1048101

SCHEMBL1048101

CCC(CC)N1CCN(c2ccc(N)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.61
KDM4E B2RXH2 5/20 0.61
GAA P10253 5/20 0.61
GFER P55789 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
RAD52 P43351 2/20 0.61
ALDH1A1 P00352 7/20 0.56
KMT2A Q03164 2/20 0.56
ADRA2C P18825 1/20 0.56
PTK2B Q14289 1/20 0.56
ESR2 Q92731 1/20 0.56
LMNA P02545 4/20 0.52
HTT P42858 2/20 0.52
MAPK1 P28482 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
CASP6 P55212 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
TP53 P04637 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48

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
SCHEMBL24223877 0.85 MAPT (0.49) MAPTKDM4EGAAGFERSMN1; SMN2
SCHEMBL5744901 0.84 MAPT (0.59) MAPTKDM4EGAAGFERSMN1; SMN2
SCHEMBL23315994 0.84 ADRB1 (0.48) MAPTKDM4EGAAGFERSMN1; SMN2
SCHEMBL188924 0.79 MAPT (0.67) MAPTKDM4EGAAGFERSMN1; SMN2
SCHEMBL6151120 0.78 MAPT (0.77) MAPTKDM4EGAAGFERSMN1; SMN2
SCHEMBL23347931 0.78 MAPT (0.77) MAPTKDM4EGAAGFERSMN1; SMN2
SCHEMBL7043679 0.78 MAPT (0.77) MAPTKDM4EGAAGFERSMN1; SMN2
SCHEMBL3973027 0.77 KDM4E (0.49) MAPTKDM4EALDH1A1LMNATP53
SCHEMBL1127098 0.76 MAPT (0.58) MAPTKDM4EGAAGFERSMN1; SMN2
SCHEMBL1813259 0.76 MAPT (0.58) MAPTKDM4EGAAGFERSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
EP-2086540-B8 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2011-03-02 EP disclosed
EP-2086540-B1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2011-01-19 EP disclosed
EP-2086540-B1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2011-01-19 EP disclosed
EP-2086540-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES Galapagos N.V. (BE) 2009-08-12 EP disclosed
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2009-04-23 US disclosed
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2009-04-23 US disclosed
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2009-04-23 US disclosed
WO-2008065198-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 WO disclosed
WO-2008065198-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 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 (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-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases COL2A1, MMP1, COL1A1 MAPT 1242/4885KDM4E 3161/4885GAA 1728/4885

“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.