SCHEMBL2866772

SCHEMBL2866772

COc1ccc(CC(=O)Nc2ccc3[nH]nc(-c4ccc(C(C)=O)cc4)c3c2)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.52
KDM4E B2RXH2 6/20 0.50
ALDH1A1 P00352 5/20 0.50
NPSR1 Q6W5P4 4/20 0.50
HPGD P15428 4/20 0.50
MAPT P10636 2/20 0.50
HSD17B10 Q99714 2/20 0.50
POLB P06746 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
SMN1; SMN2 Q16637 7/20 0.49
LMNA P02545 6/20 0.49
HTT P42858 2/20 0.49
KMT2A Q03164 4/20 0.48
USP2 O75604 2/20 0.48
RAB9A P51151 1/20 0.48
LRRK2 Q5S007 1/20 0.48
MEN1 O00255 3/20 0.48
NTRK1 P04629 1/20 0.48
NTRK2 Q16620 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL14514440 0.79 PDE4A (0.52) MAPTSMN1; SMN2KMT2AMEN1MAPK1
SCHEMBL2861158 0.78 TTK (0.65) MAPTSMN1; SMN2RAB9ALRRK2TSHR
SCHEMBL12907265 0.75 ALDH1A1 (0.59) EPHX2ALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL2867196 0.74 MAPT (0.64) KDM4EALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL3386872 0.74 KDM4E (0.56) EPHX2KDM4EALDH1A1NPSR1HPGD
SCHEMBL30544182 0.74 KMT2A (0.70) EPHX2KDM4EALDH1A1NPSR1HPGD
SCHEMBL29099829 0.74 KMT2A (0.70) EPHX2KDM4EALDH1A1NPSR1HPGD
SCHEMBL5379830 0.72 TTK (0.55) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL3384971 0.72 SMN1; SMN2 (0.58) EPHX2KDM4EALDH1A1NPSR1HPGD
SCHEMBL3383018 0.72 NTRK1 (0.55) EPHX2KDM4EALDH1A1NPSR1HPGD

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 14 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
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
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-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-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 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

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 EPHX2 2700/4885KDM4E 2531/4885ALDH1A1 1588/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 EPHX2 2366/4885KDM4E 2430/4885ALDH1A1 1744/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 EPHX2 2700/4885KDM4E 2531/4885ALDH1A1 1588/4885

“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.