SCHEMBL2863068

SCHEMBL2863068

COC(=O)c1ccc2[nH]nc(-c3cc4ccccc4o3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDR P35968 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
TNKS O95271 1/20 0.44
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
MAP2K4 P45985 2/20 0.43
MAPK1 P28482 1/20 0.43
CREBBP Q92793 1/20 0.43
JAK2 O60674 1/20 0.42
JAK3 P52333 1/20 0.42

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
SCHEMBL8253993 0.87 CSNK1D (0.54) KDRMAPK1JAK2FLT3SIRT2
SCHEMBL2872714 0.86 ITK (0.48) TP53MAPTCASP3SENP8SENP7
SCHEMBL8258574 0.86 MAPK1 (0.49) KDRMAPK1
SCHEMBL5373372 0.85 SIRT2 (0.48) TP53MAPTCASP3SENP8SENP7
SCHEMBL8256757 0.85 MAPK1 (0.54) MEN1KMT2AKDRKDM4EALDH1A1
SCHEMBL8257912 0.81 MAPK1 (0.49) KMT2AMAPK1FLT3
SCHEMBL8258494 0.80 KDM4E (0.51) TP53KDM4EALDH1A1HPGDMAPK1
SCHEMBL2861069 0.79 ALPL (0.54) MEN1KMT2AKDRKDM4EMAP2K4
SCHEMBL2864907 0.78 MAPK1 (0.69) TP53CASP3SENP7KDRNPC1
SCHEMBL8257907 0.78 KDM4E (0.55) KDM4EALDH1A1HPGDMAPK1FLT3

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 8 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
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-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
US-6982274-B2 1H-indazole compound EISAI CO., LTD. (JP) 2006-01-03 US disclosed
US-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 US disclosed
US-20040127538-A1 Novel 1h-indazole compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-07-01 US disclosed
EP-1380576-A1 NOVEL 1H-INDAZOLE COMPOUND Eisai Co., Ltd. (JP) 2004-01-14 EP 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 (3 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 TP53 1560/4885MAPT 2644/4885CASP3 292/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 TP53 2280/4885MAPT 2892/4885CASP3 644/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 TP53 1560/4885MAPT 2644/4885CASP3 292/4885

“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.