SCHEMBL2640435

SCHEMBL2640435

Clc1nc2c(-c3ccc(Br)cc3)cccn2n1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.53
JAK2 O60674 14/20 0.47
NUDT1 P36639 1/20 0.41
JAK3 P52333 9/20 0.40
PTK2 Q05397 4/20 0.40
JAK1 P23458 1/20 0.39
ALDH1A2 O94788 1/20 0.38
ALDH1A3 P47895 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
SCHEMBL2640458 0.84 JAK2 (0.49) JAK2NUDT1JAK3PTK2JAK1
SCHEMBL3260096 0.81 JAK2 (0.70) AHRJAK2NUDT1JAK3PTK2
SCHEMBL2640342 0.81 JAK2 (0.71) JAK2NUDT1JAK3PTK2JAK1
SCHEMBL2640622 0.81 JAK2 (0.50) JAK2NUDT1JAK3PTK2JAK1
SCHEMBL2640453 0.79 JAK2 (0.72) JAK2JAK3PTK2JAK1
SCHEMBL2273807 0.78 ALDH1A3 (0.47) AHRJAK2NUDT1JAK3PTK2
SCHEMBL2640289 0.78 AHR (0.54) AHRJAK2NUDT1
SCHEMBL15796871 0.73 JAK2 (0.48) AHRJAK2JAK3PTK2ALDH1A2
SCHEMBL15796893 0.72 JAK2 (0.50) AHRJAK2JAK3PTK2ALDH1A2
SCHEMBL2254333 0.72 JAK2 (0.49) AHRJAK2JAK3PTK2ALDH1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633173-B2 Preparation and uses of 1,2,4-triazolo [1,5a] pyridine derivatives CEPHALON, INC (US) 2014-01-21 US disclosed
US-20130296312-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives CEPHALON, INC. 2013-11-07 US disclosed
US-8501936-B2 Preparation and uses of 1,2,4-triazolo [1,5a] pyridine derivatives CEPHALON, INC. (US) 2013-08-06 US disclosed
EP-2438066-A2 PREPARATION AND USES OF 1,2,4-TRIAZOLO [1,5a]PYRIDINE DERIVATIVES Cephalon, Inc. (US) 2012-04-11 EP disclosed
US-20100311693-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives CEPHALON, INC. (US) 2010-12-09 US disclosed
WO-2010141796-A2 PREPARATION AND USES OF 1,2,4-TRIAZOLO [1,5a] PYRIDINE DERIVATIVES CEPHALON, INC. (US) 2010-12-09 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-20130296312-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives JAK2, JAK1, JAK3 AHR 1581/4885JAK2 1/4885NUDT1 2601/4885
US-20100311693-A1 Preparation and Uses of 1,2,4-Triazolo [1,5a] Pyridine Derivatives CCNA1, CCNY, RB1 AHR 2178/4885JAK2 31/4885NUDT1 736/4885

“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.