SCHEMBL4334934

SCHEMBL4334934

O=C(NCc1ccco1)c1cc(F)c2[nH]nc(-c3ccc4ccccc4c3)c2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.56
MAPT P10636 2/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
TSHR P16473 2/20 0.56
TP53 P04637 1/20 0.56
MAPK8 P45983 1/20 0.47
POLB P06746 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPK1 P28482 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 6/20 0.43
GAA P10253 1/20 0.43
LMNA P02545 2/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
MEN1 O00255 1/20 0.42
ESR1 P03372 1/20 0.42
KMT2A Q03164 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
SCHEMBL4327002 0.87 HPGD (0.58) HPGDMAPTNPC1RAB9ATSHR
SCHEMBL4334043 0.86 PTGDR2 (0.42) HPGDMAPTNPC1RAB9ATSHR
SCHEMBL4341443 0.85 TP53 (0.41) HPGDMAPTNPC1RAB9ATSHR
SCHEMBL4328099 0.84 MAPK1 (0.40) HPGDMAPTNPC1RAB9ATSHR
SCHEMBL4331515 0.83 TTK (0.49) HPGDMAPTNPC1RAB9ATSHR
SCHEMBL4339885 0.83 HPGD (0.51) HPGDMAPTNPC1RAB9ATSHR
SCHEMBL6426151 0.83 HPGD (0.58) HPGDMAPTNPC1RAB9ATSHR
SCHEMBL4327029 0.81 HTT (0.47) HPGDMAPTTSHRPOLBSMN1; SMN2
SCHEMBL2862711 0.80 HDAC3 (0.47)
SCHEMBL4334329 0.79 NPC1 (0.41) HPGDMAPTNPC1RAB9ATP53

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 HPGD 1817/4885MAPT 2644/4885NPC1 1164/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 HPGD 1817/4885MAPT 2644/4885NPC1 1164/4885

“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.