SCHEMBL4335969

SCHEMBL4335969

CSCC[C@@H](CO)NC(=O)c1cc(F)c2[nH]nc(-c3ccc4ccccc4c3)c2c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.37
MAPK3 P27361 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
MME P08473 2/20 0.35
ACSS2 Q9NR19 1/20 0.35
ALPL P05186 1/20 0.34
UTS2R Q9UKP6 3/20 0.34
PIN1 Q13526 3/20 0.34
FPR1 P21462 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 1/20 0.33

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
SCHEMBL4343383 0.90 MAPK1 (0.41) MAPK1MAPK3MMEACSS2ALPL
SCHEMBL4341423 0.88 ROCK1 (0.39) MAPK1MAPK3KMT2AMEN1FNTA
SCHEMBL4327408 0.87 HDAC4 (0.42) MAPK1MAPK3MMEALPLPIN1
SCHEMBL4334329 0.84 NPC1 (0.41) MAPK1MAPK3ALPLSMN1; SMN2
SCHEMBL4343384 0.83 MAPK1 (0.39) MAPK1MAPK3ALPLUTS2RPIN1
SCHEMBL4333011 0.81 MAPK1 (0.51) MAPK1MAPK3ROCK2ROCK1
SCHEMBL4343173 0.81 MAPK1 (0.36) MAPK1MAPK3MMEACSS2PIN1
SCHEMBL4334282 0.79 SCN9A (0.39) MAPK1MAPK3ALPLPIN1
SCHEMBL4334123 0.77 ROCK2 (0.43) MAPK1MAPK3MMEROCK2ROCK1
SCHEMBL2861275 0.75 CA12 (0.50) MAPK1KMT2AMEN1ALPL

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 MAPK1 1/4885MAPK3 2/4885KMT2A 2212/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 MAPK1 1/4885MAPK3 2/4885KMT2A 2212/4885

“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.