SCHEMBL4335934

SCHEMBL4335934

COc1c(NC(=O)c2ccco2)ccc2[nH]nc(-c3ccc4ccccc4c3)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPK1 P28482 2/20 0.46
MAPT P10636 5/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 2/20 0.44
HTT P42858 2/20 0.44
POLB P06746 2/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ITK Q08881 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.42
AHR P35869 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
SCHEMBL4329234 0.86 MAPT (0.44) NPC1RAB9AMAPK1MAPTKDM4E
SCHEMBL2865609 0.85 CDK4 (0.46) NPC1RAB9ALMNAPOLBITK
SCHEMBL4342242 0.83 HSD17B10 (0.43) NPC1RAB9AMAPK1MAPTKDM4E
SCHEMBL4338572 0.82 STK33 (0.47) NPC1RAB9AMAPTKDM4ELMNA
SCHEMBL2867933 0.81 CDK4 (0.42) MAPK1ITKKMT2AMEN1NPSR1
SCHEMBL4335978 0.80 GSK3B (0.47) HTTITKALDH1A1
SCHEMBL2865497 0.79 EGFR (0.43) ITKKMT2AMEN1
SCHEMBL2866649 0.78 USP2 (0.48) NPC1RAB9AMAPK1MAPTKDM4E
SCHEMBL4341196 0.78 MEN1 (0.49) NPC1RAB9AMAPK1MAPTKDM4E
SCHEMBL4340833 0.77 SMN1; SMN2 (0.47) NPC1RAB9AMAPK1MAPTKDM4E

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-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-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 NPC1 1164/4885RAB9A 2355/4885MAPK1 1/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 NPC1 1164/4885RAB9A 2355/4885MAPK1 1/4885

“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.