SCHEMBL6478798

SCHEMBL6478798

Nc1n[nH]c2cc(-c3ccccc3)c(-c3ccccc3)cc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 7/20 0.64
GSK3B P49841 3/20 0.58
GSK3A P49840 1/20 0.58
AURKB Q96GD4 2/20 0.54
MAP4K4 O95819 1/20 0.54
CSF1R P07333 1/20 0.54
FGFR1 P11362 1/20 0.54
PDGFRA P16234 1/20 0.54
LTK P29376 1/20 0.54
KDR P35968 1/20 0.54
MAPK8 P45983 1/20 0.54
CSNK1A1 P48729 1/20 0.54
LIMK1 P53667 1/20 0.54
CDK5 Q00535 1/20 0.54
ACVR1 Q04771 1/20 0.54
TNK2 Q07912 1/20 0.54
CLK4 Q9HAZ1 1/20 0.54
DYRK1B Q9Y463 1/20 0.54
PDPK1 O15530 6/20 0.53
AURKA O14965 1/20 0.53

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
SCHEMBL6479380 0.91 JAK2 (0.58) JAK2GSK3BGSK3AAURKBMAP4K4
SCHEMBL3361082 0.86 JAK2 (0.57) JAK2GSK3BGSK3AAURKBMAP4K4
SCHEMBL6489615 0.82 PDPK1 (0.53) JAK2GSK3BFGFR1PDPK1JAK1
SCHEMBL6488370 0.82 IKBKE (0.57) JAK2GSK3BGSK3AKDM4EGAA
SCHEMBL6491284 0.80 IKBKE (0.58) JAK2GSK3BGSK3AKDM4EGAA
SCHEMBL16493511 0.78 GSK3B (0.48) JAK2GSK3BGSK3AAURKBMAP4K4
SCHEMBL6490350 0.78 GSK3B (0.60) JAK2GSK3BFGFR1PDPK1CYP3A4
SCHEMBL3359889 0.78 JAK2 (1.00) JAK2GSK3BGSK3AAURKBMAP4K4
SCHEMBL3361070 0.78 JAK2 (1.00) JAK2GSK3BGSK3AAURKBKDR
SCHEMBL12907246 0.78 JAK2 (1.00) JAK2GSK3BGSK3AAURKBMAP4K4

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-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US claimed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 US claimed
EP-1487804-B1 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2014-02-26 EP disclosed
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US disclosed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 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-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof CYP2C8, NR0B2, NR2C2 JAK2 1774/4885GSK3B 2342/4885GSK3A 2830/4885

“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.