SCHEMBL17801347

SCHEMBL17801347

OCC(O)Cc1cc[nH]n1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.32
LMNA P02545 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 2/20 0.30
KDM4E B2RXH2 1/20 0.30
AGTR1 P30556 1/20 0.30

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
SCHEMBL15825345 0.82 CYP2D6 (0.32) CYP1A2KDM4E
SCHEMBL7979657 0.79 MAPT (0.38)
Pyridine SCHEMBL27898466 0.78 PTPRA (0.33) KDM4E
SCHEMBL1763335 0.78
SCHEMBL27777044 0.77 TYMP (0.40) KDM4E
SCHEMBL27756230 0.77 TYMP (0.40) KDM4E
SCHEMBL27756229 0.77 TYMP (0.40) KDM4E
SCHEMBL10635752 0.75
SCHEMBL14332153 0.74
SCHEMBL291612 0.74

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
EP-3227297-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS Array Biopharma, Inc. (US) 2017-10-11 EP disclosed
WO-2016090285-A1 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2016-06-09 WO disclosed