SCHEMBL7678712

SCHEMBL7678712

C/C(=N\NC(=O)c1[nH]c2ccccc2c1C(C)C)c1ccccn1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 13/20 0.60
RAB9A P51151 12/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
MAPT P10636 3/20 0.60
LMNA P02545 3/20 0.60
HTT P42858 2/20 0.60
KDM4E B2RXH2 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
AGTR1 P30556 7/20 0.56
KMT2A Q03164 5/20 0.56
POLB P06746 2/20 0.56
GAA P10253 6/20 0.54
OPRK1 P41145 6/20 0.51
MEN1 O00255 3/20 0.51
PKM P14618 2/20 0.51
MITF O75030 1/20 0.49
HSP90AA1 P07900 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
SCHEMBL7678715 1.00 NPC1 (0.60) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7558890 0.82 RAB9A (0.40) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7558896 0.82 RAB9A (0.40) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7561090 0.79 MAPT (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7529205 0.79 NPC1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7558851 0.79 NPC1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7561095 0.79 MAPT (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7535844 0.78 RAB9A (0.60) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7564275 0.78 RAB9A (0.60) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL7561222 0.77 MAPT (0.61) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020091148-A1 3-substituted indole antiproliferative angiogenesis inhibitors ABBOTT LABORATORIES 2002-07-11 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 (1 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-20020091148-A1 3-substituted indole antiproliferative angiogenesis inhibitors MKI67, FLT4, IDO1 NPC1 3749/4885RAB9A 3961/4885SMN1; SMN2 4745/4885

“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.