SCHEMBL18170767

SCHEMBL18170767

CN(C)c1ccccc1C(=O)Nc1ccc(-c2ccccc2)c2c1C(=O)NC2

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.53
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.38
BRD4 O60885 1/20 0.38
MAP3K9 P80192 1/20 0.37
MAP3K11 Q16584 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 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
SCHEMBL18170808 0.86 KDR (0.58) KDRALDH1A1MAPT
SCHEMBL18170746 0.85 KDR (0.58) KDRGAAALDH1A1HTT
SCHEMBL18170741 0.84 KDR (0.53) KDRALDH1A1MAPT
SCHEMBL18170481 0.84 KDR (0.53) KDRALDH1A1HTTMAPT
SCHEMBL18170477 0.84 KDR (0.56) KDRALDH1A1MAP3K9MAP3K11HTT
SCHEMBL18170607 0.83 KDR (0.60) KDR
SCHEMBL18170654 0.83 CASP3 (0.54) KDRGAAALDH1A1HTTMAPT
SCHEMBL18170444 0.83 KDR (0.53) KDRGAAALDH1A1MAPT
SCHEMBL18170870 0.82 KDR (0.52) KDRALDH1A1MAP3K9MAP3K11HTT
SCHEMBL18171025 0.82 KDR (0.69) KDRMAP3K9MAP3K11

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-9856216-B2 Compounds as TNIK, IKKε and TBK1 inhibitors and pharmaceutical composition comprising same GREEN CROSS CORPORATION (KR) 2018-01-02 US claimed
US-20160311772-A1 COMPOUNDS AS TNIK, IKKEPSILON AND TBK1 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-27 US claimed
US-9856216-B2 Compounds as TNIK, IKKε and TBK1 inhibitors and pharmaceutical composition comprising same GREEN CROSS CORPORATION (KR) 2018-01-02 US disclosed
US-20160311772-A1 COMPOUNDS AS TNIK, IKKEPSILON AND TBK1 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-27 US disclosed
US-20160311772-A1 COMPOUNDS AS TNIK, IKKEPSILON AND TBK1 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN CROSS CORPORATION (KR) 2016-10-27 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-20160311772-A1 COMPOUNDS AS TNIK, IKKEPSILON AND TBK1 INHIBITORS AND PHARMACEUTICAL COMPOSITION COMPRISING SAME TNIK, TNK1, NFKBIA KDR 1662/4885GAA 2982/4885ALDH1A1 4760/4885

“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.