SCHEMBL4334043

SCHEMBL4334043

O=C(NCc1cc2ccccc2o1)c1cc(F)c2[nH]nc(-c3ccc4ccccc4c3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.42
CSNK1D P48730 1/20 0.39
PIN1 Q13526 1/20 0.39
TP53 P04637 3/20 0.39
HPGD P15428 2/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
USP2 O75604 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KLKB1 P03952 1/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL4340581 0.90 CSNK1D (0.42) PTGDR2CSNK1DTP53HPGDUSP2
SCHEMBL4341443 0.86 TP53 (0.41) CSNK1DTP53HPGDMAPTNPC1
SCHEMBL4334934 0.86 HPGD (0.56) TP53HPGDMAPTNPC1TSHR
SCHEMBL4331515 0.83 TTK (0.49) HPGDMAPTNPC1TSHRRAB9A
SCHEMBL4332115 0.82 CSNK1D (0.43) PTGDR2CSNK1DTP53HPGDMAPT
SCHEMBL4328099 0.82 MAPK1 (0.40) CSNK1DTP53HPGDMAPTNPC1
SCHEMBL2862711 0.81 HDAC3 (0.47) HDAC2ROCK2ITK
SCHEMBL4327029 0.80 HTT (0.47) HPGDMAPTTSHRUSP2ALDH1A1
SCHEMBL4332464 0.79 CSNK1D (0.41) PTGDR2CSNK1DTP53HPGDMAPT
SCHEMBL4334329 0.79 NPC1 (0.41) CSNK1DTP53HPGDMAPTNPC1

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 PTGDR2 1870/4885CSNK1D 134/4885PIN1 673/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 PTGDR2 1870/4885CSNK1D 134/4885PIN1 673/4885

“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.