SCHEMBL18170563

SCHEMBL18170563

Cc1ccc(-c2ccc(N)c3c2CNC3=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.61
CSF1R P07333 2/20 0.41
ROCK2 O75116 2/20 0.38
MAP4K4 O95819 2/20 0.38
LCK P06239 2/20 0.38
RET P07949 2/20 0.38
PIM1 P11309 2/20 0.38
RPS6KB1 P23443 2/20 0.38
BLK P51451 2/20 0.38
STK3 Q13188 2/20 0.38
ROCK1 Q13464 2/20 0.38
NTRK3 Q16288 2/20 0.38
TAOK1 Q7L7X3 2/20 0.38
HIPK4 Q8NE63 2/20 0.38
AURKB Q96GD4 2/20 0.38
MKNK2 Q9HBH9 2/20 0.38
MAP4K5 Q9Y4K4 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
PLK4 O00444 1/20 0.38
AURKA O14965 1/20 0.38

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
SCHEMBL18170540 0.85 KDR (0.52) KDRCSF1RMAP4K4NTRK3NTRK1
SCHEMBL18170475 0.85 KDR (0.52) KDRCSF1RPIM1ROCK1CLK4
SCHEMBL3046347 0.85 KDR (0.55) KDRCSF1RROCK2MAP3K9MAP3K11
SCHEMBL3043388 0.84 KDR (0.54) KDRCSF1RPIM1CLK4PRKD3
SCHEMBL18170608 0.84 KDR (0.52) KDRROCK2AURKBPLK4AURKA
SCHEMBL30701043 0.83 KDR (0.50) KDRCSF1RAURKBAURKAMAP3K9
SCHEMBL18170546 0.83 KDR (0.50) KDRCSF1RAURKBAURKAMAP3K9
SCHEMBL18170855 0.83 KDR (0.56) KDRCSF1RROCK2MAP4K4LCK
SCHEMBL1333256 0.77 KDR (1.00) KDRCSF1RROCK2MAP4K4LCK
SCHEMBL3039573 0.77 KDR (0.43) KDRCSF1RROCK2MAP4K4LCK

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-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-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
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 1662/4885CSF1R 2206/4885ROCK2 202/4885

“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.