SCHEMBL4340974

SCHEMBL4340974

COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1C(=O)NCCNC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.49
MAP4K4 O95819 1/20 0.48
MAP2K4 P45985 4/20 0.44
MAPK1 P28482 5/20 0.42
TLR9 Q9NR96 1/20 0.42
TLR8 Q9NR97 1/20 0.42
TLR7 Q9NYK1 1/20 0.42
TTK P33981 2/20 0.41
MAPK8 P45983 2/20 0.41
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
MAP3K5 Q99683 1/20 0.40

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
SCHEMBL4334482 0.88 MAP4K4 (0.51) NTRK1MAP4K4MAP2K4MAPK1TTK
SCHEMBL4334601 0.87 MAP4K4 (0.50) NTRK1MAP4K4MAP2K4MAPK1TTK
SCHEMBL2868590 0.83 DYRK1A (0.50) NTRK1MAP4K4MAP2K4
SCHEMBL4329145 0.83 HPGD (0.48) NTRK1TLR8TLR7MAPK8
SCHEMBL4329328 0.83 RECQL (0.60) NTRK1MAPK1
SCHEMBL2864251 0.82 MAP2K4 (0.54) NTRK1MAP2K4MAPK1TTKMAPK8
SCHEMBL4343211 0.82 MAP4K4 (0.45) NTRK1MAP4K4MAP2K4TLR9TLR8
SCHEMBL4343155 0.80 NTRK1 (0.47) NTRK1MAP2K4MAPK1
SCHEMBL4334940 0.79 MAP4K4 (0.48) NTRK1MAP4K4MAP2K4MAPK1TTK
SCHEMBL4336457 0.78 MAPK1 (0.50) NTRK1MAP2K4MAPK1TTKMAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
EP-1380576-B1 1H-INDAZOLE COMPOUNDS INHIBITING JNK EISAI R&D MAN CO LTD (JP) 2009-11-25 EP disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
US-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 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 (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-20090203691-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 NTRK1 1241/4885MAP4K4 63/4885MAP2K4 61/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 NTRK1 1241/4885MAP4K4 63/4885MAP2K4 61/4885

“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.