SCHEMBL18129593

SCHEMBL18129593

CC(C)NC(=O)N1CCC(c2c[nH]c3ncc(-c4ccc(CN5CCOCC5)cc4)cc23)=CC1C

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 2/20 0.55
MAP3K11 Q16584 9/20 0.49
TNIK Q9UKE5 9/20 0.47
MAP3K9 P80192 1/20 0.46
IKBKB O14920 1/20 0.45
CHUK O15111 1/20 0.45
ABL1 P00519 1/20 0.45
INSR P06213 1/20 0.45
CDK2 P24941 1/20 0.45
FLT3 P36888 1/20 0.45

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
SCHEMBL18129769 0.92 MAP3K11 (0.60) MAP4K1MAP3K11TNIKMAP3K9IKBKB
SCHEMBL18129473 0.91 MAP4K1 (0.54) MAP4K1MAP3K11TNIKMAP3K9IKBKB
SCHEMBL20841546 0.88 MAP4K1 (0.51) MAP4K1MAP3K11TNIKMAP3K9IKBKB
SCHEMBL18129570 0.87 TBK1 (0.42) MAP4K1MAP3K11
SCHEMBL18129643 0.86 MAP4K1 (0.55) MAP4K1MAP3K11TNIKIKBKBCHUK
SCHEMBL18129538 0.83 MAP3K11 (0.57) MAP4K1MAP3K11TNIKMAP3K9IKBKB
SCHEMBL18129676 0.82 MAP3K11 (0.59) MAP4K1MAP3K11TNIKMAP3K9IKBKB
SCHEMBL18129621 0.81 TBK1 (0.41) MAP4K1MAP3K11
SCHEMBL18129661 0.80 MAP3K11 (0.44) MAP4K1MAP3K11TNIKMAP3K9IKBKB
SCHEMBL18129542 0.80 MAP3K11 (0.57) MAP4K1MAP3K11TNIK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10239873-B2 7-azaindole or 4,7-diazaindole derivatives as IKKϵ epsilon and TBK1 inhibitor and pharmaceutical composition comprising same GREEN CROSS CORPORATION (KR) 2019-03-26 US claimed
US-20160297815-A1 7-AZAINDOLE OR 4,7-DIAZAINDOLE DERIVATIVES AS IKK EPSILON AND TBK1 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-13 US claimed
US-10239873-B2 7-azaindole or 4,7-diazaindole derivatives as IKKϵ epsilon and TBK1 inhibitor and pharmaceutical composition comprising same GREEN CROSS CORPORATION (KR) 2019-03-26 US disclosed
US-10239873-B2 7-azaindole or 4,7-diazaindole derivatives as IKKϵ epsilon and TBK1 inhibitor and pharmaceutical composition comprising same GREEN CROSS CORPORATION (KR) 2019-03-26 US disclosed
US-20160297815-A1 7-AZAINDOLE OR 4,7-DIAZAINDOLE DERIVATIVES AS IKK EPSILON AND TBK1 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-13 US disclosed
US-20160297815-A1 7-AZAINDOLE OR 4,7-DIAZAINDOLE DERIVATIVES AS IKK EPSILON AND TBK1 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-13 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-20160297815-A1 7-AZAINDOLE OR 4,7-DIAZAINDOLE DERIVATIVES AS IKK EPSILON AND TBK1 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME TANK, NFKBIA, TBK1 MAP4K1 766/4885MAP3K11 519/4885TNIK 14/4885
US-10239873-B2 7-azaindole or 4,7-diazaindole derivatives as IKKϵ epsilon and TBK1 inhibitor and pharmaceutical composition comprising same NFKBIA, TANK, TBK1 MAP4K1 858/4885MAP3K11 600/4885TNIK 16/4885

“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.