SCHEMBL5539669

SCHEMBL5539669

c1ccc(Oc2ccc(-c3cnc4[nH]nc(-c5ccc[nH]5)c4c3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 1/20 0.41
GSK3B P49841 2/20 0.40
GSK3A P49840 1/20 0.40
AKT1 P31749 2/20 0.40
LTA4H P09960 3/20 0.39
IGF1R P08069 1/20 0.39
AXL P30530 2/20 0.39
CDK8 P49336 2/20 0.39
TNIK Q9UKE5 1/20 0.39
RIPK1 Q13546 1/20 0.38
KDR P35968 1/20 0.37
NPC1 O15118 1/20 0.37
SCN4A P35499 1/20 0.37
RAB9A P51151 1/20 0.37
BTK Q06187 2/20 0.36
CAMKK2 Q96RR4 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
SCHEMBL5534996 0.90 GSK3B (0.48) GSK3BGSK3AAXLCDK8TNIK
SCHEMBL5537040 0.89 GSK3B (0.49) GSK3BGSK3AAXLCDK8TNIK
SCHEMBL5536712 0.87 KIT (0.46) MAP4K1AKT1
SCHEMBL5542634 0.87 PRMT5 (0.45) MAP4K1GSK3BAKT1
SCHEMBL5536743 0.85 GSK3B (0.46) GSK3BGSK3AAKT1AXLCDK8
SCHEMBL5539363 0.85 CAMKK2 (0.50) GSK3BGSK3AAKT1IGF1RAXL
SCHEMBL5533779 0.81 DYRK1B (0.43) AKT1
SCHEMBL5537386 0.81 AXL (0.45) GSK3BGSK3AAXLCDK8TNIK
SCHEMBL5539202 0.79 KIT (0.46) GSK3BGSK3AAKT1AXLCDK8
SCHEMBL5530500 0.76 GRIN1 (0.39) AKT1TNIKNPC1BTK

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-7186716-B2 3-Pyrrol-pyridopyrazoles and 3-pyrrolyl-indazoles as novel kinase inhibitors SUGEN, INC. (US) 2007-03-06 US claimed
US-20040092546-A1 3-Pyrrol-pyridopyrazoles and 3-pyrrolyl-indazoles as novel kinase inhibitors SUGEN, INC. 2004-05-13 US claimed
US-7186716-B2 3-Pyrrol-pyridopyrazoles and 3-pyrrolyl-indazoles as novel kinase inhibitors SUGEN, INC. (US) 2007-03-06 US disclosed
US-7186716-B2 3-Pyrrol-pyridopyrazoles and 3-pyrrolyl-indazoles as novel kinase inhibitors SUGEN, INC. (US) 2007-03-06 US disclosed
US-7186716-B2 3-Pyrrol-pyridopyrazoles and 3-pyrrolyl-indazoles as novel kinase inhibitors SUGEN, INC. (US) 2007-03-06 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 (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-20040092546-A1 3-Pyrrol-pyridopyrazoles and 3-pyrrolyl-indazoles as novel kinase inhibitors MAP3K19, MAP3K1, MAP3K7 MAP4K1 22/4885GSK3B 597/4885GSK3A 682/4885

“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.