SCHEMBL4289557

SCHEMBL4289557

COc1cccc([C@@H](C)NC(=O)c2cc(-c3ccc4[nH]ncc4c3)on2)c1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 16/20 0.60
PIM1 P11309 1/20 0.60
GSK3B P49841 1/20 0.60
ROCK1 Q13464 16/20 0.58
TP53 P04637 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
MAPT P10636 1/20 0.52

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
SCHEMBL4285228 0.88 ROCK2 (0.68) ROCK2PIM1GSK3BROCK1MAPT
SCHEMBL4291905 0.88 ROCK2 (0.68) ROCK2PIM1GSK3BROCK1MAPT
SCHEMBL4289384 0.86 ROCK2 (0.63) ROCK2PIM1GSK3BROCK1TP53
SCHEMBL3636663 0.85 ROCK2 (0.59) ROCK2PIM1GSK3BROCK1TP53
SCHEMBL4298374 0.84 ROCK2 (0.62) ROCK2PIM1GSK3BROCK1TP53
SCHEMBL4286440 0.83 ROCK2 (0.67) ROCK2PIM1GSK3BROCK1TP53
SCHEMBL4295851 0.83 ROCK2 (0.67) ROCK2PIM1GSK3BROCK1TP53
SCHEMBL4291700 0.83 ROCK2 (0.63) ROCK2PIM1GSK3BROCK1TP53
SCHEMBL3673482 0.82 ROCK2 (0.66) ROCK2PIM1GSK3BROCK1TP53
SCHEMBL3632707 0.82 ROCK2 (0.66) ROCK2PIM1GSK3BROCK1SMN1; SMN2

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-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
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2009-08-13 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-20140343066-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 ROCK2 48/4885PIM1 11/4885GSK3B 1/4885
US-20090203690-A1 5-SUBSTITUTED INDAZOLES AS KINASE INHIBITORS GSK3B, GSK3A, PIM3 ROCK2 48/4885PIM1 11/4885GSK3B 1/4885

“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.