SCHEMBL15428703

SCHEMBL15428703

Cc1ccc(Cl)cc1-c1nn(CCO)cc1N

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 7/20 0.40
JAK1 P23458 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
CRHR1 P34998 1/20 0.37
MDM4 O15151 1/20 0.35
MDM2 Q00987 1/20 0.35
AGPAT2 O15120 1/20 0.35
MAPK8 P45983 1/20 0.35
MAP4K4 O95819 1/20 0.34
TYK2 P29597 1/20 0.34
SPR P35270 1/20 0.34
IDO1 P14902 1/20 0.34
MARS1 P56192 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
SCHEMBL15428701 0.83 JAK2 (0.45) JAK2JAK1TYK2SPRMARS1
SCHEMBL404276 0.82 CYP3A4 (0.47) JAK2JAK1KMT2AMEN1CYP3A4
SCHEMBL406731 0.71 MMP12 (0.46) JAK2JAK1CYP3A4AGPAT2TYK2
SCHEMBL12748050 0.71 MEN1 (0.45) JAK2JAK1KMT2AMEN1MAP4K4
SCHEMBL1559261 0.68 MEN1 (0.38) KMT2AMEN1
SCHEMBL27860625 0.68 MAP4K4 (0.43) JAK2CYP3A4CRHR1MDM4MDM2
SCHEMBL402641 0.66 TEAD2 (0.52) JAK2KMT2AMEN1MAP4K4
SCHEMBL6835004 0.65 HSD11B1 (0.49) CYP3A4CRHR1
SCHEMBL17981699 0.65 KMT2A (0.44) KMT2ACRHR1
SCHEMBL400178 0.65 TEAD2 (0.48) JAK2KMT2AMEN1

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
US-20160244456-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2016-08-25 US disclosed
EP-2962566-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS Genentech, Inc. (US) 2016-01-06 EP disclosed
EP-2348860-B1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH INC (US) 2015-05-27 EP disclosed
US-20140107099-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2014-04-17 US disclosed
US-8637526-B2 Pyrazolopyrimidine JAK inhibitor compounds and methods GENENTECH, INC. (US) 2014-01-28 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 (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-20140107099-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885KMT2A 1030/4885
US-20160244456-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885KMT2A 1030/4885

“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.