SCHEMBL6759841

SCHEMBL6759841

COc1ccc2[nH]c(NCc3cccc(N)c3)nc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
TP53 P04637 3/20 0.62
EGFR P00533 3/20 0.49
IGF1R P08069 1/20 0.49
GAA P10253 1/20 0.48
ALDH1A1 P00352 3/20 0.46
HTT P42858 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 2/20 0.46
POLB P06746 1/20 0.46
PKM P14618 1/20 0.46
HPGD P15428 1/20 0.46
APP P05067 1/20 0.45
KDR P35968 1/20 0.45
LMNA P02545 2/20 0.44
GFER P55789 1/20 0.44
HIF1A Q16665 1/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL6757771 0.82 TP53 (0.57) RAB9ASMN1; SMN2TP53EGFRIGF1R
SCHEMBL2028202 0.81 RAB9A (0.71) RAB9ASMN1; SMN2TP53GAAALDH1A1
SCHEMBL17487921 0.78 RAB9A (0.52) RAB9ASMN1; SMN2TP53EGFRIGF1R
SCHEMBL18254877 0.78 ROCK2 (0.56) RAB9ASMN1; SMN2TP53EGFRIGF1R
SCHEMBL17487924 0.77 RAB9A (0.43) RAB9ASMN1; SMN2TP53EGFRIGF1R
SCHEMBL18254878 0.77 ROCK2 (0.59) RAB9ASMN1; SMN2TP53
SCHEMBL17487324 0.76 RAB9A (0.51) RAB9ASMN1; SMN2TP53GAAALDH1A1
SCHEMBL17487328 0.75 RAB9A (0.54) RAB9ASMN1; SMN2TP53GAAALDH1A1
SCHEMBL28805360 0.74 RAB9A (0.72) RAB9ASMN1; SMN2TP53GAAALDH1A1
SCHEMBL13812986 0.73 MAPT (0.59) RAB9AGAAALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040087798-A1 Novel amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 US disclosed
EP-1264820-A1 NOVEL AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 EP 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-20040087798-A1 Novel amide compounds H1-2, H1-0, H1-3 RAB9A 1818/4885SMN1; SMN2 2625/4885TP53 2814/4885

“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.