SCHEMBL4079787

SCHEMBL4079787

N#Cc1ccc(F)c(C(=O)c2ccc3ccccc3c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B14 Q9BPX1 2/20 0.55
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
VNN1 O95497 1/20 0.46
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
CDY1; CDY1B Q9Y6F8 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
F2 P00734 1/20 0.43
PLG P00747 1/20 0.43
PLAU P00749 1/20 0.43
KLKB1 P03952 1/20 0.43
PRSS1 P07477 1/20 0.43
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL3950626 0.88 HSD17B14 (0.51) HSD17B14NPC1RAB9AMEN1KMT2A
SCHEMBL2857473 0.85 HSD17B14 (0.50) HSD17B14NPC1RAB9AMEN1KMT2A
SCHEMBL3956887 0.84 KDM4E (0.48) HSD17B14NPC1VNN1SMN1; SMN2MAPT
SCHEMBL4094642 0.81 CHRNA7 (0.49) HSD17B14RAB9AMEN1KMT2AVNN1
SCHEMBL4080048 0.81 VNN1 (0.51) HSD17B14NPC1RAB9AVNN1SMN1; SMN2
SCHEMBL2861875 0.81 HSD17B14 (0.51) HSD17B14NPC1RAB9AMEN1KMT2A
SCHEMBL5804959 0.80 PKM (0.45) HSD17B14NPC1RAB9AMEN1KMT2A
SCHEMBL9487939 0.78 HSD17B14 (0.57) HSD17B14NPC1RAB9AMEN1KMT2A
SCHEMBL27536100 0.78 HSD17B14 (0.63) HSD17B14NPC1RAB9AMEN1KMT2A
SCHEMBL4145394 0.77 HSD17B14 (0.48) HSD17B14NPC1RAB9AMEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
EP-1692128-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2006-08-23 EP disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed
WO-2005051942-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2005-06-09 WO 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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 HSD17B14 2313/4885NPC1 2971/4885RAB9A 3047/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 HSD17B14 2148/4885NPC1 2941/4885RAB9A 3208/4885

“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.