SCHEMBL2372424

SCHEMBL2372424

OCCN1CCN(c2ccc(Nc3nccc4nc(-c5c(F)cccc5Cl)[nH]c34)nc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 5/20 0.50
JAK2 O60674 2/20 0.50
CDK4 P11802 7/20 0.46
CCNA2 P20248 4/20 0.46
CDK1 P06493 3/20 0.46
CDK2 P24941 3/20 0.46
CCND1 P24385 2/20 0.46
CCNB1 P14635 1/20 0.46
CCNA1 P78396 1/20 0.46
WEE1 P30291 2/20 0.40
CDK6 Q00534 6/20 0.40
CCND3 P30281 4/20 0.40
CTSC P53634 2/20 0.40
CSF1R P07333 1/20 0.39
CCNE2 O96020 1/20 0.38
CCNK O75909 1/20 0.36
CDK9 P50750 1/20 0.36

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
SCHEMBL2372556 0.94 JAK2 (0.55) TYK2JAK2CDK4CCNA2CDK1
SCHEMBL2369933 0.90 TYK2 (0.54) TYK2JAK2CDK4CCNA2CDK1
SCHEMBL2372671 0.89 JAK2 (0.54) TYK2JAK2CDK4CCNA2CDK1
SCHEMBL2383213 0.87 TYK2 (0.49) TYK2JAK2CDK6CCND3CCNK
SCHEMBL2371361 0.85 TYK2 (0.70) TYK2JAK2WEE1CSF1R
SCHEMBL2372126 0.84 JAK2 (0.56) TYK2JAK2WEE1CSF1R
SCHEMBL12296260 0.83 JAK2 (0.48) TYK2JAK2CDK4CCNA2CDK1
SCHEMBL2372584 0.83 TYK2 (0.60) TYK2JAK2CDK4CCNA2CDK1
SCHEMBL2372075 0.83 JAK2 (0.59) TYK2JAK2CDK4CCNA2CDK1
SCHEMBL2371085 0.82 TYK2 (0.43) TYK2JAK2

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-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
US-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
US-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
EP-2547338-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. Hoffmann-La Roche AG (CH) 2013-01-23 EP disclosed
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 WO disclosed
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 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-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TYK2, IRAK1, IRAK4 TYK2 1/4885JAK2 6/4885CDK4 143/4885

“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.