SCHEMBL3217348

SCHEMBL3217348

Cc1ccc(-c2ccc3c(C(N)=O)c(NC(N)=O)[nH]c3c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.48
KDM4E B2RXH2 2/20 0.43
GAA P10253 1/20 0.43
PDGFRB P09619 4/20 0.41
KDR P35968 3/20 0.41
ABL1 P00519 4/20 0.40
BCR P11274 2/20 0.40
GSK3B P49841 1/20 0.40
MITF O75030 1/20 0.40
MAPT P10636 1/20 0.40
ICMT O60725 1/20 0.40
MPL P40238 1/20 0.37
CDC7 O00311 1/20 0.37
CHEK2 O96017 1/20 0.37
CSF1R P07333 2/20 0.37
TNKS2 Q9H2K2 2/20 0.37
PLK4 O00444 1/20 0.37
CHEK1 O14757 1/20 0.37
DAPK3 O43293 1/20 0.37
PRKD3 O94806 1/20 0.37

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
SCHEMBL3205976 0.89 MAPT (0.50) KIF11KDM4EGAAPDGFRBKDR
SCHEMBL3205678 0.89 PDGFRB (0.49) PDGFRBKDRABL1MITFMAPT
SCHEMBL3206124 0.88 FEN1 (0.44) PDGFRBKDRGSK3BCHEK2TNKS2
SCHEMBL9885160 0.88 GSK3B (0.42) KIF11PDGFRBKDRABL1BCR
SCHEMBL3215596 0.87 TNKS2 (0.45) KIF11PDGFRBABL1BCRGSK3B
SCHEMBL3212694 0.87 MAP2 (0.42) KIF11CHEK2MAP4K4
SCHEMBL3220420 0.86 JAK2 (0.47) KDM4EGAAGSK3BMAPTCDC7
SCHEMBL3209276 0.86 GSK3B (0.45) ABL1BCRGSK3BMPLCSF1R
SCHEMBL3206899 0.86 GSK3B (0.43) ABL1GSK3BCDC7LRRK2
SCHEMBL13613324 0.86 KIF11 (0.40) KIF11PDGFRBKDRCHEK2CSF1R

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
EP-2119703-B1 NOVEL INDOLE DERIVATIVE HAVING INHIBITORY ACTIVITY ON I B KINASE SANTEN PHARMACEUTICAL CO LTD (JP) 2012-12-12 EP disclosed
US-8193237-B2 Indole derivative having IκB kinase β inhibitory activity SANTEN PHARMACEUTICAL CO., LTD. (JP) 2012-06-05 US disclosed
US-8193237-B2 Indole derivative having IκB kinase β inhibitory activity SANTEN PHARMACEUTICAL CO., LTD. (JP) 2012-06-05 US disclosed
US-8193237-B2 Indole derivative having IκB kinase β inhibitory activity SANTEN PHARMACEUTICAL CO., LTD. (JP) 2012-06-05 US disclosed
US-20100041628-A1 NOVEL INDOLE DERIVATIVE HAVING IKAPPAB KINASE BETA INHIBITORY ACTIVITY SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-02-18 US disclosed
US-20100041628-A1 NOVEL INDOLE DERIVATIVE HAVING IKAPPAB KINASE BETA INHIBITORY ACTIVITY SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-02-18 US disclosed
US-20100041628-A1 NOVEL INDOLE DERIVATIVE HAVING IKAPPAB KINASE BETA INHIBITORY ACTIVITY SANTEN PHARMACEUTICAL CO., LTD. (JP) 2010-02-18 US disclosed
EP-2119703-A1 NOVEL INDOLE DERIVATIVE HAVING INHIBITORY ACTIVITY ON I B KINASE Santen Pharmaceutical Co., Ltd (JP) 2009-11-18 EP disclosed
EP-2119703-A1 NOVEL INDOLE DERIVATIVE HAVING INHIBITORY ACTIVITY ON I B KINASE Santen Pharmaceutical Co., Ltd (JP) 2009-11-18 EP 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-20100041628-A1 NOVEL INDOLE DERIVATIVE HAVING IKAPPAB KINASE BETA INHIBITORY ACTIVITY NFKBIA, IKBKB, IKBKG KIF11 2732/4885KDM4E 1670/4885GAA 3503/4885

“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.