SCHEMBL3671941

SCHEMBL3671941

COc1ncccc1-c1ccc2[nH]nc(N)c2c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 9/20 0.56
JAK1 P23458 1/20 0.56
TYK2 P29597 1/20 0.56
JAK3 P52333 1/20 0.56
LOXL2 Q9Y4K0 1/20 0.55
LRRK2 Q5S007 2/20 0.54
ALOX5AP P20292 2/20 0.51
FEN1 P39748 2/20 0.51
GSK3B P49841 2/20 0.50
BTK Q06187 1/20 0.46
METAP2 P50579 1/20 0.43
PDPK1 O15530 1/20 0.43
DHFR P00374 1/20 0.43

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
SCHEMBL12907240 0.80 JAK2 (0.63) JAK2JAK1TYK2JAK3ALOX5AP
SCHEMBL31240788 0.78 JAK2 (0.54) JAK2JAK1TYK2JAK3ALOX5AP
SCHEMBL15639917 0.76 JAK2 (0.49) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL1509530 0.76 ALOX5AP (0.55) LOXL2ALOX5APFEN1BTKMETAP2
SCHEMBL2660051 0.74 JAK2 (0.55) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL4540461 0.74 DYRK1B (0.55) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL15639843 0.73 JAK2 (0.58) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL12907168 0.73 PRKAG1 (0.68) JAK2JAK1TYK2JAK3
SCHEMBL558935 0.73 ALOX5AP (0.55) LOXL2ALOX5APFEN1GSK3BBTK
SCHEMBL980447 0.73 MAP4K4 (0.63) LOXL2ALOX5APFEN1BTKDHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101790526-A 5-heteroaryl substituted indazoles as kinase inhibitors ABBOTT GMBH & CO KG 2010-07-28 CN claimed
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-08-13 US claimed
US-9163007-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2015-10-20 US disclosed
US-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS AbbVie Deutschland GmbH & Co. KG (DE) 2014-11-20 US disclosed
US-8648069-B2 5-substituted indazoles as kinase inhibitors ABBVIE INC. (US) 2014-02-11 US disclosed
CN-101790526-A 5-heteroaryl substituted indazoles as kinase inhibitors ABBOTT GMBH & CO KG 2010-07-28 CN disclosed
EP-2167491-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS Abbott Laboratories (US) 2010-03-31 EP disclosed
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-08-13 US disclosed
WO-2008154241-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2008-12-18 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-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 JAK2 102/4885JAK1 73/4885TYK2 153/4885
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 JAK2 102/4885JAK1 73/4885TYK2 153/4885

“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.